USER MOD reduce.3.24.130724 H: found=0, std=0, add=868, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 864 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -163:sc= -0.0346 (180deg=-0.325) USER MOD Single : A 4 THR OG1 : rot -50:sc= 0.804 USER MOD Single : A 6 CYS SG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0144 USER MOD Single : A 11 MET CE :methyl 143:sc= -0.653 (180deg=-4.35!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot -56:sc= 0.0234 USER MOD Single : A 25 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00301) USER MOD Single : A 26 LYS NZ :NH3+ 157:sc= -0.0876 (180deg=-0.468) USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= -0.0517 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= -0.144 K(o=-0.14,f=-1.7) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.295 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot -91:sc= 0.519 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -0.79 X(o=-0.79,f=-1.2) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 SER OG : rot 150:sc= 0 USER MOD Single : A 66 THR OG1 : rot -53:sc= 0.841 USER MOD Single : A 67 ASN : amide:sc= -0.0317 K(o=-0.032,f=-1.1) USER MOD Single : A 78 SER OG : rot -14:sc= 0.988 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 HIS : no HD1:sc= -0.005 X(o=-0.005,f=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= -0.051 USER MOD Single : A 97 TYR OH : rot -178:sc= -1.76! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.214 0.405 4.865 1.00 24.13 N ATOM 2 CA MET A 1 1.317 -0.279 4.200 1.00 63.00 C ATOM 3 C MET A 1 1.165 -1.793 4.312 1.00 50.42 C ATOM 4 O MET A 1 1.707 -2.415 5.225 1.00 45.44 O ATOM 5 CB MET A 1 2.654 0.157 4.803 1.00 30.33 C ATOM 6 CG MET A 1 2.950 1.636 4.620 1.00 40.41 C ATOM 7 SD MET A 1 4.476 2.146 5.434 1.00 31.45 S ATOM 8 CE MET A 1 5.680 1.772 4.162 1.00 11.01 C ATOM 0 H1 MET A 1 0.173 1.393 4.542 1.00 24.13 H new ATOM 0 H2 MET A 1 -0.680 -0.073 4.634 1.00 24.13 H new ATOM 0 H3 MET A 1 0.362 0.384 5.894 1.00 24.13 H new ATOM 0 HA MET A 1 1.297 -0.007 3.145 1.00 63.00 H new ATOM 0 HB2 MET A 1 2.656 -0.076 5.868 1.00 30.33 H new ATOM 0 HB3 MET A 1 3.455 -0.425 4.347 1.00 30.33 H new ATOM 0 HG2 MET A 1 3.019 1.860 3.555 1.00 40.41 H new ATOM 0 HG3 MET A 1 2.119 2.220 5.016 1.00 40.41 H new ATOM 0 HE1 MET A 1 6.677 2.033 4.517 1.00 11.01 H new ATOM 0 HE2 MET A 1 5.645 0.708 3.929 1.00 11.01 H new ATOM 0 HE3 MET A 1 5.452 2.347 3.265 1.00 11.01 H new ATOM 18 N ALA A 2 0.423 -2.379 3.378 1.00 44.13 N ATOM 19 CA ALA A 2 0.202 -3.820 3.371 1.00 14.51 C ATOM 20 C ALA A 2 0.372 -4.395 1.969 1.00 3.22 C ATOM 21 O ALA A 2 -0.154 -3.854 0.998 1.00 55.44 O ATOM 22 CB ALA A 2 -1.184 -4.143 3.911 1.00 4.32 C ATOM 0 H ALA A 2 -0.035 -1.878 2.617 1.00 44.13 H new ATOM 0 HA ALA A 2 0.949 -4.281 4.017 1.00 14.51 H new ATOM 0 HB1 ALA A 2 -1.336 -5.222 3.900 1.00 4.32 H new ATOM 0 HB2 ALA A 2 -1.271 -3.774 4.933 1.00 4.32 H new ATOM 0 HB3 ALA A 2 -1.938 -3.664 3.287 1.00 4.32 H new ATOM 28 N ALA A 3 1.112 -5.494 1.872 1.00 64.41 N ATOM 29 CA ALA A 3 1.351 -6.143 0.589 1.00 62.41 C ATOM 30 C ALA A 3 1.652 -7.627 0.772 1.00 63.12 C ATOM 31 O ALA A 3 2.311 -8.024 1.734 1.00 72.23 O ATOM 32 CB ALA A 3 2.494 -5.458 -0.145 1.00 1.41 C ATOM 0 H ALA A 3 1.556 -5.954 2.667 1.00 64.41 H new ATOM 0 HA ALA A 3 0.444 -6.054 -0.009 1.00 62.41 H new ATOM 0 HB1 ALA A 3 2.661 -5.953 -1.101 1.00 1.41 H new ATOM 0 HB2 ALA A 3 2.241 -4.412 -0.318 1.00 1.41 H new ATOM 0 HB3 ALA A 3 3.400 -5.517 0.457 1.00 1.41 H new ATOM 38 N THR A 4 1.165 -8.444 -0.157 1.00 63.12 N ATOM 39 CA THR A 4 1.381 -9.884 -0.097 1.00 74.24 C ATOM 40 C THR A 4 0.998 -10.441 1.269 1.00 2.02 C ATOM 41 O THR A 4 1.565 -11.433 1.727 1.00 21.14 O ATOM 42 CB THR A 4 2.848 -10.246 -0.394 1.00 42.30 C ATOM 43 OG1 THR A 4 3.658 -9.990 0.759 1.00 44.44 O ATOM 44 CG2 THR A 4 3.374 -9.447 -1.577 1.00 53.12 C ATOM 0 H THR A 4 0.618 -8.133 -0.960 1.00 63.12 H new ATOM 0 HA THR A 4 0.744 -10.331 -0.860 1.00 74.24 H new ATOM 0 HB THR A 4 2.895 -11.306 -0.643 1.00 42.30 H new ATOM 0 HG1 THR A 4 3.476 -9.087 1.093 1.00 44.44 H new ATOM 0 HG21 THR A 4 4.412 -9.720 -1.768 1.00 53.12 H new ATOM 0 HG22 THR A 4 2.773 -9.666 -2.460 1.00 53.12 H new ATOM 0 HG23 THR A 4 3.314 -8.382 -1.352 1.00 53.12 H new ATOM 52 N VAL A 5 0.032 -9.797 1.917 1.00 45.44 N ATOM 53 CA VAL A 5 -0.427 -10.229 3.231 1.00 12.10 C ATOM 54 C VAL A 5 -1.893 -9.870 3.446 1.00 73.21 C ATOM 55 O VAL A 5 -2.224 -8.724 3.751 1.00 52.21 O ATOM 56 CB VAL A 5 0.415 -9.597 4.356 1.00 74.33 C ATOM 57 CG1 VAL A 5 -0.151 -9.968 5.718 1.00 1.43 C ATOM 58 CG2 VAL A 5 1.869 -10.028 4.238 1.00 51.20 C ATOM 0 H VAL A 5 -0.448 -8.974 1.553 1.00 45.44 H new ATOM 0 HA VAL A 5 -0.312 -11.312 3.266 1.00 12.10 H new ATOM 0 HB VAL A 5 0.372 -8.513 4.254 1.00 74.33 H new ATOM 0 HG11 VAL A 5 0.456 -9.513 6.501 1.00 1.43 H new ATOM 0 HG12 VAL A 5 -1.176 -9.606 5.797 1.00 1.43 H new ATOM 0 HG13 VAL A 5 -0.139 -11.052 5.834 1.00 1.43 H new ATOM 0 HG21 VAL A 5 2.450 -9.573 5.040 1.00 51.20 H new ATOM 0 HG22 VAL A 5 1.934 -11.113 4.314 1.00 51.20 H new ATOM 0 HG23 VAL A 5 2.267 -9.707 3.275 1.00 51.20 H new ATOM 68 N CYS A 6 -2.768 -10.857 3.285 1.00 25.33 N ATOM 69 CA CYS A 6 -4.200 -10.646 3.462 1.00 70.15 C ATOM 70 C CYS A 6 -4.598 -10.814 4.924 1.00 14.42 C ATOM 71 O CYS A 6 -4.442 -11.889 5.503 1.00 23.30 O ATOM 72 CB CYS A 6 -4.992 -11.622 2.590 1.00 45.02 C ATOM 73 SG CYS A 6 -4.954 -11.233 0.824 1.00 4.45 S ATOM 0 H CYS A 6 -2.510 -11.811 3.032 1.00 25.33 H new ATOM 0 HA CYS A 6 -4.432 -9.626 3.156 1.00 70.15 H new ATOM 0 HB2 CYS A 6 -4.597 -12.627 2.738 1.00 45.02 H new ATOM 0 HB3 CYS A 6 -6.029 -11.634 2.926 1.00 45.02 H new ATOM 0 HG CYS A 6 -5.650 -12.115 0.170 1.00 4.45 H new ATOM 79 N THR A 7 -5.114 -9.742 5.519 1.00 45.35 N ATOM 80 CA THR A 7 -5.532 -9.769 6.914 1.00 3.44 C ATOM 81 C THR A 7 -7.032 -10.010 7.034 1.00 31.03 C ATOM 82 O THR A 7 -7.807 -9.597 6.171 1.00 15.15 O ATOM 83 CB THR A 7 -5.176 -8.453 7.633 1.00 61.31 C ATOM 84 OG1 THR A 7 -4.397 -7.618 6.769 1.00 74.13 O ATOM 85 CG2 THR A 7 -4.402 -8.728 8.913 1.00 23.41 C ATOM 0 H THR A 7 -5.252 -8.844 5.055 1.00 45.35 H new ATOM 0 HA THR A 7 -4.996 -10.591 7.389 1.00 3.44 H new ATOM 0 HB THR A 7 -6.104 -7.943 7.891 1.00 61.31 H new ATOM 0 HG1 THR A 7 -4.176 -6.783 7.233 1.00 74.13 H new ATOM 0 HG21 THR A 7 -4.162 -7.784 9.403 1.00 23.41 H new ATOM 0 HG22 THR A 7 -5.009 -9.339 9.581 1.00 23.41 H new ATOM 0 HG23 THR A 7 -3.480 -9.258 8.674 1.00 23.41 H new ATOM 93 N ILE A 8 -7.435 -10.680 8.109 1.00 63.34 N ATOM 94 CA ILE A 8 -8.843 -10.975 8.341 1.00 12.42 C ATOM 95 C ILE A 8 -9.272 -10.539 9.738 1.00 14.21 C ATOM 96 O ILE A 8 -8.534 -9.846 10.437 1.00 10.14 O ATOM 97 CB ILE A 8 -9.140 -12.476 8.170 1.00 33.02 C ATOM 98 CG1 ILE A 8 -7.838 -13.259 7.993 1.00 42.03 C ATOM 99 CG2 ILE A 8 -10.066 -12.701 6.984 1.00 42.03 C ATOM 100 CD1 ILE A 8 -7.230 -13.117 6.615 1.00 75.14 C ATOM 0 H ILE A 8 -6.806 -11.028 8.832 1.00 63.34 H new ATOM 0 HA ILE A 8 -9.410 -10.415 7.597 1.00 12.42 H new ATOM 0 HB ILE A 8 -9.639 -12.837 9.069 1.00 33.02 H new ATOM 0 HG12 ILE A 8 -7.116 -12.921 8.736 1.00 42.03 H new ATOM 0 HG13 ILE A 8 -8.028 -14.314 8.190 1.00 42.03 H new ATOM 0 HG21 ILE A 8 -10.267 -13.767 6.876 1.00 42.03 H new ATOM 0 HG22 ILE A 8 -11.004 -12.170 7.149 1.00 42.03 H new ATOM 0 HG23 ILE A 8 -9.592 -12.327 6.076 1.00 42.03 H new ATOM 0 HD11 ILE A 8 -6.310 -13.699 6.562 1.00 75.14 H new ATOM 0 HD12 ILE A 8 -7.934 -13.482 5.867 1.00 75.14 H new ATOM 0 HD13 ILE A 8 -7.008 -12.068 6.422 1.00 75.14 H new ATOM 112 N ALA A 9 -10.471 -10.951 10.139 1.00 65.44 N ATOM 113 CA ALA A 9 -10.997 -10.607 11.454 1.00 62.14 C ATOM 114 C ALA A 9 -9.925 -10.751 12.529 1.00 71.22 C ATOM 115 O ALA A 9 -9.702 -9.837 13.323 1.00 61.14 O ATOM 116 CB ALA A 9 -12.200 -11.478 11.785 1.00 40.50 C ATOM 0 H ALA A 9 -11.096 -11.523 9.571 1.00 65.44 H new ATOM 0 HA ALA A 9 -11.313 -9.564 11.431 1.00 62.14 H new ATOM 0 HB1 ALA A 9 -12.583 -11.211 12.770 1.00 40.50 H new ATOM 0 HB2 ALA A 9 -12.979 -11.322 11.038 1.00 40.50 H new ATOM 0 HB3 ALA A 9 -11.901 -12.526 11.784 1.00 40.50 H new ATOM 122 N ASP A 10 -9.266 -11.904 12.549 1.00 24.22 N ATOM 123 CA ASP A 10 -8.217 -12.168 13.527 1.00 5.33 C ATOM 124 C ASP A 10 -7.230 -13.205 13.000 1.00 42.43 C ATOM 125 O ASP A 10 -7.046 -14.263 13.600 1.00 14.03 O ATOM 126 CB ASP A 10 -8.827 -12.650 14.844 1.00 21.11 C ATOM 127 CG ASP A 10 -9.887 -11.704 15.372 1.00 52.43 C ATOM 128 OD1 ASP A 10 -9.524 -10.740 16.079 1.00 72.21 O ATOM 129 OD2 ASP A 10 -11.080 -11.926 15.077 1.00 40.22 O ATOM 0 H ASP A 10 -9.439 -12.671 11.899 1.00 24.22 H new ATOM 0 HA ASP A 10 -7.678 -11.237 13.704 1.00 5.33 H new ATOM 0 HB2 ASP A 10 -9.266 -13.637 14.698 1.00 21.11 H new ATOM 0 HB3 ASP A 10 -8.038 -12.759 15.588 1.00 21.11 H new ATOM 134 N MET A 11 -6.598 -12.893 11.873 1.00 70.13 N ATOM 135 CA MET A 11 -5.630 -13.798 11.265 1.00 62.35 C ATOM 136 C MET A 11 -4.833 -13.089 10.174 1.00 73.32 C ATOM 137 O MET A 11 -5.247 -12.046 9.667 1.00 42.03 O ATOM 138 CB MET A 11 -6.340 -15.021 10.681 1.00 62.33 C ATOM 139 CG MET A 11 -5.412 -16.197 10.423 1.00 64.15 C ATOM 140 SD MET A 11 -6.278 -17.635 9.765 1.00 14.01 S ATOM 141 CE MET A 11 -7.081 -16.920 8.332 1.00 33.44 C ATOM 0 H MET A 11 -6.739 -12.021 11.363 1.00 70.13 H new ATOM 0 HA MET A 11 -4.938 -14.125 12.041 1.00 62.35 H new ATOM 0 HB2 MET A 11 -7.128 -15.334 11.365 1.00 62.33 H new ATOM 0 HB3 MET A 11 -6.823 -14.738 9.746 1.00 62.33 H new ATOM 0 HG2 MET A 11 -4.634 -15.894 9.722 1.00 64.15 H new ATOM 0 HG3 MET A 11 -4.914 -16.472 11.353 1.00 64.15 H new ATOM 0 HE1 MET A 11 -7.081 -17.643 7.516 1.00 33.44 H new ATOM 0 HE2 MET A 11 -8.108 -16.657 8.584 1.00 33.44 H new ATOM 0 HE3 MET A 11 -6.543 -16.024 8.022 1.00 33.44 H new ATOM 151 N THR A 12 -3.688 -13.662 9.816 1.00 1.14 N ATOM 152 CA THR A 12 -2.833 -13.084 8.787 1.00 30.02 C ATOM 153 C THR A 12 -2.460 -14.122 7.735 1.00 33.42 C ATOM 154 O THR A 12 -1.605 -14.977 7.967 1.00 3.43 O ATOM 155 CB THR A 12 -1.544 -12.497 9.392 1.00 23.11 C ATOM 156 OG1 THR A 12 -1.868 -11.602 10.462 1.00 62.11 O ATOM 157 CG2 THR A 12 -0.736 -11.760 8.334 1.00 15.13 C ATOM 0 H THR A 12 -3.331 -14.526 10.224 1.00 1.14 H new ATOM 0 HA THR A 12 -3.403 -12.282 8.317 1.00 30.02 H new ATOM 0 HB THR A 12 -0.942 -13.320 9.777 1.00 23.11 H new ATOM 0 HG1 THR A 12 -1.043 -11.235 10.842 1.00 62.11 H new ATOM 0 HG21 THR A 12 0.170 -11.354 8.785 1.00 15.13 H new ATOM 0 HG22 THR A 12 -0.466 -12.451 7.536 1.00 15.13 H new ATOM 0 HG23 THR A 12 -1.332 -10.946 7.922 1.00 15.13 H new ATOM 165 N VAL A 13 -3.107 -14.043 6.577 1.00 75.22 N ATOM 166 CA VAL A 13 -2.842 -14.976 5.488 1.00 54.53 C ATOM 167 C VAL A 13 -1.758 -14.441 4.559 1.00 72.24 C ATOM 168 O VAL A 13 -1.680 -13.239 4.306 1.00 51.13 O ATOM 169 CB VAL A 13 -4.115 -15.255 4.666 1.00 21.42 C ATOM 170 CG1 VAL A 13 -3.812 -16.210 3.521 1.00 51.51 C ATOM 171 CG2 VAL A 13 -5.213 -15.813 5.559 1.00 11.22 C ATOM 0 H VAL A 13 -3.819 -13.343 6.368 1.00 75.22 H new ATOM 0 HA VAL A 13 -2.501 -15.906 5.943 1.00 54.53 H new ATOM 0 HB VAL A 13 -4.466 -14.315 4.241 1.00 21.42 H new ATOM 0 HG11 VAL A 13 -4.723 -16.396 2.951 1.00 51.51 H new ATOM 0 HG12 VAL A 13 -3.059 -15.768 2.868 1.00 51.51 H new ATOM 0 HG13 VAL A 13 -3.437 -17.151 3.922 1.00 51.51 H new ATOM 0 HG21 VAL A 13 -6.105 -16.004 4.962 1.00 11.22 H new ATOM 0 HG22 VAL A 13 -4.874 -16.744 6.014 1.00 11.22 H new ATOM 0 HG23 VAL A 13 -5.448 -15.091 6.341 1.00 11.22 H new ATOM 181 N ASP A 14 -0.924 -15.343 4.053 1.00 43.54 N ATOM 182 CA ASP A 14 0.156 -14.962 3.149 1.00 22.53 C ATOM 183 C ASP A 14 -0.079 -15.529 1.753 1.00 41.05 C ATOM 184 O ASP A 14 -0.186 -16.742 1.574 1.00 2.11 O ATOM 185 CB ASP A 14 1.500 -15.452 3.692 1.00 12.20 C ATOM 186 CG ASP A 14 2.439 -14.310 4.027 1.00 23.11 C ATOM 187 OD1 ASP A 14 2.000 -13.363 4.712 1.00 44.33 O ATOM 188 OD2 ASP A 14 3.613 -14.364 3.604 1.00 43.40 O ATOM 0 H ASP A 14 -0.975 -16.342 4.253 1.00 43.54 H new ATOM 0 HA ASP A 14 0.174 -13.874 3.082 1.00 22.53 H new ATOM 0 HB2 ASP A 14 1.330 -16.053 4.585 1.00 12.20 H new ATOM 0 HB3 ASP A 14 1.971 -16.102 2.955 1.00 12.20 H new ATOM 193 N MET A 15 -0.160 -14.642 0.766 1.00 65.32 N ATOM 194 CA MET A 15 -0.382 -15.055 -0.615 1.00 51.42 C ATOM 195 C MET A 15 0.932 -15.441 -1.286 1.00 23.53 C ATOM 196 O MET A 15 0.944 -15.926 -2.417 1.00 44.24 O ATOM 197 CB MET A 15 -1.058 -13.931 -1.403 1.00 14.22 C ATOM 198 CG MET A 15 -0.214 -12.671 -1.510 1.00 75.15 C ATOM 199 SD MET A 15 -0.550 -11.737 -3.015 1.00 55.54 S ATOM 200 CE MET A 15 -1.912 -10.705 -2.477 1.00 33.54 C ATOM 0 H MET A 15 -0.075 -13.634 0.897 1.00 65.32 H new ATOM 0 HA MET A 15 -1.035 -15.928 -0.606 1.00 51.42 H new ATOM 0 HB2 MET A 15 -1.289 -14.290 -2.406 1.00 14.22 H new ATOM 0 HB3 MET A 15 -2.007 -13.684 -0.926 1.00 14.22 H new ATOM 0 HG2 MET A 15 -0.403 -12.037 -0.644 1.00 75.15 H new ATOM 0 HG3 MET A 15 0.841 -12.942 -1.483 1.00 75.15 H new ATOM 0 HE1 MET A 15 -2.233 -10.067 -3.301 1.00 33.54 H new ATOM 0 HE2 MET A 15 -2.743 -11.335 -2.161 1.00 33.54 H new ATOM 0 HE3 MET A 15 -1.590 -10.083 -1.642 1.00 33.54 H new ATOM 210 N VAL A 16 2.038 -15.224 -0.580 1.00 72.32 N ATOM 211 CA VAL A 16 3.357 -15.551 -1.107 1.00 24.10 C ATOM 212 C VAL A 16 3.941 -16.774 -0.408 1.00 73.13 C ATOM 213 O VAL A 16 4.730 -17.518 -0.992 1.00 15.32 O ATOM 214 CB VAL A 16 4.333 -14.370 -0.950 1.00 10.45 C ATOM 215 CG1 VAL A 16 4.013 -13.275 -1.956 1.00 61.12 C ATOM 216 CG2 VAL A 16 4.288 -13.828 0.471 1.00 24.24 C ATOM 0 H VAL A 16 2.046 -14.823 0.358 1.00 72.32 H new ATOM 0 HA VAL A 16 3.228 -15.769 -2.167 1.00 24.10 H new ATOM 0 HB VAL A 16 5.344 -14.728 -1.147 1.00 10.45 H new ATOM 0 HG11 VAL A 16 4.713 -12.449 -1.830 1.00 61.12 H new ATOM 0 HG12 VAL A 16 4.100 -13.673 -2.967 1.00 61.12 H new ATOM 0 HG13 VAL A 16 2.996 -12.917 -1.793 1.00 61.12 H new ATOM 0 HG21 VAL A 16 4.984 -12.994 0.565 1.00 24.24 H new ATOM 0 HG22 VAL A 16 3.278 -13.486 0.698 1.00 24.24 H new ATOM 0 HG23 VAL A 16 4.570 -14.616 1.170 1.00 24.24 H new ATOM 226 N ARG A 17 3.547 -16.977 0.845 1.00 50.22 N ATOM 227 CA ARG A 17 4.031 -18.110 1.624 1.00 3.20 C ATOM 228 C ARG A 17 2.920 -19.131 1.847 1.00 71.32 C ATOM 229 O ARG A 17 3.179 -20.272 2.231 1.00 3.31 O ATOM 230 CB ARG A 17 4.578 -17.633 2.971 1.00 60.20 C ATOM 231 CG ARG A 17 5.843 -16.799 2.854 1.00 10.30 C ATOM 232 CD ARG A 17 6.450 -16.513 4.219 1.00 40.03 C ATOM 233 NE ARG A 17 7.899 -16.341 4.148 1.00 14.32 N ATOM 234 CZ ARG A 17 8.637 -15.901 5.161 1.00 34.35 C ATOM 235 NH1 ARG A 17 8.065 -15.592 6.317 1.00 51.30 N ATOM 236 NH2 ARG A 17 9.950 -15.771 5.020 1.00 35.22 N ATOM 0 H ARG A 17 2.894 -16.371 1.342 1.00 50.22 H new ATOM 0 HA ARG A 17 4.833 -18.589 1.062 1.00 3.20 H new ATOM 0 HB2 ARG A 17 3.812 -17.046 3.477 1.00 60.20 H new ATOM 0 HB3 ARG A 17 4.782 -18.501 3.599 1.00 60.20 H new ATOM 0 HG2 ARG A 17 6.570 -17.324 2.234 1.00 10.30 H new ATOM 0 HG3 ARG A 17 5.615 -15.859 2.352 1.00 10.30 H new ATOM 0 HD2 ARG A 17 5.998 -15.613 4.635 1.00 40.03 H new ATOM 0 HD3 ARG A 17 6.215 -17.332 4.899 1.00 40.03 H new ATOM 0 HE ARG A 17 8.370 -16.571 3.273 1.00 14.32 H new ATOM 0 HH11 ARG A 17 7.056 -15.692 6.430 1.00 51.30 H new ATOM 0 HH12 ARG A 17 8.634 -15.254 7.093 1.00 51.30 H new ATOM 0 HH21 ARG A 17 10.394 -16.009 4.133 1.00 35.22 H new ATOM 0 HH22 ARG A 17 10.516 -15.433 5.799 1.00 35.22 H new ATOM 250 N ARG A 18 1.682 -18.714 1.603 1.00 11.42 N ATOM 251 CA ARG A 18 0.531 -19.591 1.779 1.00 61.31 C ATOM 252 C ARG A 18 0.452 -20.103 3.214 1.00 32.22 C ATOM 253 O ARG A 18 0.447 -21.311 3.455 1.00 3.14 O ATOM 254 CB ARG A 18 0.610 -20.772 0.809 1.00 42.52 C ATOM 255 CG ARG A 18 0.127 -20.441 -0.594 1.00 13.33 C ATOM 256 CD ARG A 18 1.168 -19.650 -1.370 1.00 64.51 C ATOM 257 NE ARG A 18 1.028 -19.830 -2.813 1.00 4.03 N ATOM 258 CZ ARG A 18 1.408 -20.928 -3.457 1.00 4.30 C ATOM 259 NH1 ARG A 18 1.948 -21.938 -2.790 1.00 63.41 N ATOM 260 NH2 ARG A 18 1.248 -21.016 -4.771 1.00 61.12 N ATOM 0 H ARG A 18 1.450 -17.774 1.283 1.00 11.42 H new ATOM 0 HA ARG A 18 -0.369 -19.014 1.567 1.00 61.31 H new ATOM 0 HB2 ARG A 18 1.642 -21.120 0.756 1.00 42.52 H new ATOM 0 HB3 ARG A 18 0.016 -21.596 1.204 1.00 42.52 H new ATOM 0 HG2 ARG A 18 -0.103 -21.363 -1.128 1.00 13.33 H new ATOM 0 HG3 ARG A 18 -0.798 -19.867 -0.536 1.00 13.33 H new ATOM 0 HD2 ARG A 18 1.075 -18.592 -1.126 1.00 64.51 H new ATOM 0 HD3 ARG A 18 2.165 -19.962 -1.061 1.00 64.51 H new ATOM 0 HE ARG A 18 0.616 -19.071 -3.356 1.00 4.03 H new ATOM 0 HH11 ARG A 18 2.073 -21.873 -1.780 1.00 63.41 H new ATOM 0 HH12 ARG A 18 2.239 -22.780 -3.287 1.00 63.41 H new ATOM 0 HH21 ARG A 18 0.833 -20.240 -5.287 1.00 61.12 H new ATOM 0 HH22 ARG A 18 1.540 -21.859 -5.265 1.00 61.12 H new ATOM 274 N THR A 19 0.390 -19.176 4.165 1.00 33.22 N ATOM 275 CA THR A 19 0.312 -19.533 5.576 1.00 4.31 C ATOM 276 C THR A 19 -0.839 -18.808 6.264 1.00 21.20 C ATOM 277 O THR A 19 -1.495 -17.956 5.666 1.00 53.33 O ATOM 278 CB THR A 19 1.625 -19.202 6.312 1.00 73.21 C ATOM 279 OG1 THR A 19 1.719 -17.791 6.535 1.00 10.13 O ATOM 280 CG2 THR A 19 2.828 -19.675 5.511 1.00 62.43 C ATOM 0 H THR A 19 0.392 -18.172 3.983 1.00 33.22 H new ATOM 0 HA THR A 19 0.139 -20.608 5.621 1.00 4.31 H new ATOM 0 HB THR A 19 1.620 -19.721 7.270 1.00 73.21 H new ATOM 0 HG1 THR A 19 2.555 -17.589 7.005 1.00 10.13 H new ATOM 0 HG21 THR A 19 3.743 -19.430 6.050 1.00 62.43 H new ATOM 0 HG22 THR A 19 2.768 -20.754 5.368 1.00 62.43 H new ATOM 0 HG23 THR A 19 2.836 -19.180 4.540 1.00 62.43 H new ATOM 288 N VAL A 20 -1.079 -19.152 7.525 1.00 12.04 N ATOM 289 CA VAL A 20 -2.151 -18.532 8.296 1.00 62.51 C ATOM 290 C VAL A 20 -1.738 -18.334 9.750 1.00 34.11 C ATOM 291 O VAL A 20 -1.573 -19.300 10.496 1.00 11.31 O ATOM 292 CB VAL A 20 -3.437 -19.379 8.249 1.00 0.44 C ATOM 293 CG1 VAL A 20 -4.280 -19.002 7.041 1.00 75.42 C ATOM 294 CG2 VAL A 20 -3.098 -20.862 8.233 1.00 53.43 C ATOM 0 H VAL A 20 -0.546 -19.857 8.035 1.00 12.04 H new ATOM 0 HA VAL A 20 -2.348 -17.561 7.842 1.00 62.51 H new ATOM 0 HB VAL A 20 -4.020 -19.174 9.147 1.00 0.44 H new ATOM 0 HG11 VAL A 20 -5.184 -19.610 7.024 1.00 75.42 H new ATOM 0 HG12 VAL A 20 -4.553 -17.948 7.102 1.00 75.42 H new ATOM 0 HG13 VAL A 20 -3.708 -19.177 6.130 1.00 75.42 H new ATOM 0 HG21 VAL A 20 -4.018 -21.445 8.200 1.00 53.43 H new ATOM 0 HG22 VAL A 20 -2.493 -21.088 7.354 1.00 53.43 H new ATOM 0 HG23 VAL A 20 -2.539 -21.117 9.133 1.00 53.43 H new ATOM 304 N ILE A 21 -1.574 -17.077 10.146 1.00 13.54 N ATOM 305 CA ILE A 21 -1.183 -16.751 11.512 1.00 23.52 C ATOM 306 C ILE A 21 -2.372 -16.239 12.318 1.00 44.33 C ATOM 307 O ILE A 21 -2.934 -15.187 12.013 1.00 44.33 O ATOM 308 CB ILE A 21 -0.063 -15.694 11.540 1.00 14.05 C ATOM 309 CG1 ILE A 21 1.237 -16.281 10.987 1.00 12.03 C ATOM 310 CG2 ILE A 21 0.142 -15.178 12.957 1.00 64.21 C ATOM 311 CD1 ILE A 21 1.294 -16.305 9.476 1.00 43.40 C ATOM 0 H ILE A 21 -1.706 -16.267 9.540 1.00 13.54 H new ATOM 0 HA ILE A 21 -0.813 -17.672 11.962 1.00 23.52 H new ATOM 0 HB ILE A 21 -0.358 -14.856 10.908 1.00 14.05 H new ATOM 0 HG12 ILE A 21 2.078 -15.700 11.365 1.00 12.03 H new ATOM 0 HG13 ILE A 21 1.356 -17.297 11.363 1.00 12.03 H new ATOM 0 HG21 ILE A 21 0.937 -14.432 12.961 1.00 64.21 H new ATOM 0 HG22 ILE A 21 -0.782 -14.726 13.317 1.00 64.21 H new ATOM 0 HG23 ILE A 21 0.419 -16.006 13.609 1.00 64.21 H new ATOM 0 HD11 ILE A 21 2.243 -16.734 9.154 1.00 43.40 H new ATOM 0 HD12 ILE A 21 0.473 -16.910 9.091 1.00 43.40 H new ATOM 0 HD13 ILE A 21 1.207 -15.288 9.092 1.00 43.40 H new ATOM 323 N ARG A 22 -2.748 -16.988 13.349 1.00 74.15 N ATOM 324 CA ARG A 22 -3.870 -16.609 14.199 1.00 73.20 C ATOM 325 C ARG A 22 -3.392 -15.804 15.404 1.00 63.23 C ATOM 326 O ARG A 22 -2.852 -16.361 16.360 1.00 14.41 O ATOM 327 CB ARG A 22 -4.624 -17.854 14.671 1.00 65.32 C ATOM 328 CG ARG A 22 -6.123 -17.646 14.801 1.00 15.20 C ATOM 329 CD ARG A 22 -6.790 -17.530 13.439 1.00 11.22 C ATOM 330 NE ARG A 22 -6.888 -18.822 12.766 1.00 35.21 N ATOM 331 CZ ARG A 22 -7.863 -19.696 12.992 1.00 22.22 C ATOM 332 NH1 ARG A 22 -8.818 -19.418 13.869 1.00 5.31 N ATOM 333 NH2 ARG A 22 -7.884 -20.852 12.340 1.00 2.40 N ATOM 0 H ARG A 22 -2.292 -17.861 13.616 1.00 74.15 H new ATOM 0 HA ARG A 22 -4.544 -15.986 13.611 1.00 73.20 H new ATOM 0 HB2 ARG A 22 -4.438 -18.668 13.970 1.00 65.32 H new ATOM 0 HB3 ARG A 22 -4.224 -18.166 15.636 1.00 65.32 H new ATOM 0 HG2 ARG A 22 -6.560 -18.479 15.352 1.00 15.20 H new ATOM 0 HG3 ARG A 22 -6.317 -16.743 15.380 1.00 15.20 H new ATOM 0 HD2 ARG A 22 -7.787 -17.107 13.559 1.00 11.22 H new ATOM 0 HD3 ARG A 22 -6.223 -16.839 12.815 1.00 11.22 H new ATOM 0 HE ARG A 22 -6.169 -19.067 12.085 1.00 35.21 H new ATOM 0 HH11 ARG A 22 -8.806 -18.531 14.372 1.00 5.31 H new ATOM 0 HH12 ARG A 22 -9.565 -20.091 14.040 1.00 5.31 H new ATOM 0 HH21 ARG A 22 -7.151 -21.070 11.665 1.00 2.40 H new ATOM 0 HH22 ARG A 22 -8.633 -21.522 12.514 1.00 2.40 H new ATOM 347 N SER A 23 -3.592 -14.491 15.349 1.00 34.32 N ATOM 348 CA SER A 23 -3.178 -13.609 16.434 1.00 44.04 C ATOM 349 C SER A 23 -1.714 -13.844 16.795 1.00 11.41 C ATOM 350 O SER A 23 -1.329 -13.756 17.960 1.00 0.32 O ATOM 351 CB SER A 23 -4.060 -13.828 17.664 1.00 71.41 C ATOM 352 OG SER A 23 -4.029 -12.701 18.521 1.00 0.35 O ATOM 0 H SER A 23 -4.038 -14.015 14.565 1.00 34.32 H new ATOM 0 HA SER A 23 -3.291 -12.579 16.095 1.00 44.04 H new ATOM 0 HB2 SER A 23 -5.086 -14.022 17.350 1.00 71.41 H new ATOM 0 HB3 SER A 23 -3.721 -14.711 18.206 1.00 71.41 H new ATOM 0 HG SER A 23 -3.102 -12.507 18.772 1.00 0.35 H new ATOM 358 N GLY A 24 -0.902 -14.143 15.786 1.00 71.04 N ATOM 359 CA GLY A 24 0.510 -14.386 16.016 1.00 31.12 C ATOM 360 C GLY A 24 0.810 -15.847 16.290 1.00 53.44 C ATOM 361 O GLY A 24 1.897 -16.189 16.754 1.00 2.12 O ATOM 0 H GLY A 24 -1.197 -14.221 14.813 1.00 71.04 H new ATOM 0 HA2 GLY A 24 1.078 -14.059 15.145 1.00 31.12 H new ATOM 0 HA3 GLY A 24 0.846 -13.785 16.861 1.00 31.12 H new ATOM 365 N LYS A 25 -0.157 -16.711 16.002 1.00 35.24 N ATOM 366 CA LYS A 25 0.007 -18.144 16.220 1.00 53.40 C ATOM 367 C LYS A 25 -0.396 -18.932 14.978 1.00 65.22 C ATOM 368 O LYS A 25 -1.581 -19.150 14.724 1.00 4.52 O ATOM 369 CB LYS A 25 -0.830 -18.597 17.418 1.00 20.53 C ATOM 370 CG LYS A 25 -0.382 -17.992 18.737 1.00 22.12 C ATOM 371 CD LYS A 25 -1.063 -16.659 18.999 1.00 20.31 C ATOM 372 CE LYS A 25 -0.772 -16.151 20.403 1.00 44.34 C ATOM 373 NZ LYS A 25 -1.579 -16.865 21.430 1.00 24.22 N ATOM 0 H LYS A 25 -1.063 -16.444 15.617 1.00 35.24 H new ATOM 0 HA LYS A 25 1.060 -18.337 16.426 1.00 53.40 H new ATOM 0 HB2 LYS A 25 -1.873 -18.333 17.242 1.00 20.53 H new ATOM 0 HB3 LYS A 25 -0.784 -19.684 17.492 1.00 20.53 H new ATOM 0 HG2 LYS A 25 -0.607 -18.682 19.550 1.00 22.12 H new ATOM 0 HG3 LYS A 25 0.699 -17.853 18.726 1.00 22.12 H new ATOM 0 HD2 LYS A 25 -0.723 -15.926 18.268 1.00 20.31 H new ATOM 0 HD3 LYS A 25 -2.139 -16.767 18.866 1.00 20.31 H new ATOM 0 HE2 LYS A 25 0.288 -16.277 20.622 1.00 44.34 H new ATOM 0 HE3 LYS A 25 -0.983 -15.083 20.454 1.00 44.34 H new ATOM 0 HZ1 LYS A 25 -1.377 -16.467 22.369 1.00 24.22 H new ATOM 0 HZ2 LYS A 25 -2.591 -16.752 21.217 1.00 24.22 H new ATOM 0 HZ3 LYS A 25 -1.334 -17.876 21.423 1.00 24.22 H new ATOM 387 N LYS A 26 0.598 -19.360 14.207 1.00 43.04 N ATOM 388 CA LYS A 26 0.349 -20.127 12.992 1.00 22.31 C ATOM 389 C LYS A 26 -0.437 -21.397 13.302 1.00 21.13 C ATOM 390 O LYS A 26 0.016 -22.246 14.070 1.00 23.52 O ATOM 391 CB LYS A 26 1.672 -20.487 12.311 1.00 13.02 C ATOM 392 CG LYS A 26 1.497 -21.234 11.000 1.00 44.51 C ATOM 393 CD LYS A 26 1.764 -20.333 9.806 1.00 55.53 C ATOM 394 CE LYS A 26 3.247 -20.270 9.474 1.00 74.31 C ATOM 395 NZ LYS A 26 3.764 -21.583 8.997 1.00 53.33 N ATOM 0 H LYS A 26 1.584 -19.189 14.402 1.00 43.04 H new ATOM 0 HA LYS A 26 -0.244 -19.509 12.317 1.00 22.31 H new ATOM 0 HB2 LYS A 26 2.237 -19.573 12.126 1.00 13.02 H new ATOM 0 HB3 LYS A 26 2.267 -21.097 12.991 1.00 13.02 H new ATOM 0 HG2 LYS A 26 2.175 -22.087 10.973 1.00 44.51 H new ATOM 0 HG3 LYS A 26 0.484 -21.631 10.938 1.00 44.51 H new ATOM 0 HD2 LYS A 26 1.212 -20.701 8.941 1.00 55.53 H new ATOM 0 HD3 LYS A 26 1.395 -19.329 10.017 1.00 55.53 H new ATOM 0 HE2 LYS A 26 3.416 -19.513 8.708 1.00 74.31 H new ATOM 0 HE3 LYS A 26 3.804 -19.959 10.358 1.00 74.31 H new ATOM 0 HZ1 LYS A 26 4.622 -21.433 8.429 1.00 53.33 H new ATOM 0 HZ2 LYS A 26 3.991 -22.184 9.815 1.00 53.33 H new ATOM 0 HZ3 LYS A 26 3.040 -22.050 8.414 1.00 53.33 H new ATOM 409 N ILE A 27 -1.615 -21.520 12.700 1.00 22.40 N ATOM 410 CA ILE A 27 -2.461 -22.688 12.911 1.00 74.03 C ATOM 411 C ILE A 27 -1.936 -23.894 12.140 1.00 74.25 C ATOM 412 O ILE A 27 -1.525 -23.775 10.985 1.00 61.41 O ATOM 413 CB ILE A 27 -3.916 -22.413 12.484 1.00 24.40 C ATOM 414 CG1 ILE A 27 -4.463 -21.188 13.219 1.00 42.24 C ATOM 415 CG2 ILE A 27 -4.786 -23.632 12.754 1.00 42.22 C ATOM 416 CD1 ILE A 27 -4.598 -21.389 14.712 1.00 40.23 C ATOM 0 H ILE A 27 -2.005 -20.826 12.063 1.00 22.40 H new ATOM 0 HA ILE A 27 -2.439 -22.905 13.979 1.00 74.03 H new ATOM 0 HB ILE A 27 -3.933 -22.208 11.414 1.00 24.40 H new ATOM 0 HG12 ILE A 27 -3.805 -20.339 13.033 1.00 42.24 H new ATOM 0 HG13 ILE A 27 -5.438 -20.932 12.805 1.00 42.24 H new ATOM 0 HG21 ILE A 27 -5.811 -23.423 12.447 1.00 42.22 H new ATOM 0 HG22 ILE A 27 -4.405 -24.483 12.190 1.00 42.22 H new ATOM 0 HG23 ILE A 27 -4.766 -23.865 13.819 1.00 42.22 H new ATOM 0 HD11 ILE A 27 -4.991 -20.480 15.167 1.00 40.23 H new ATOM 0 HD12 ILE A 27 -5.279 -22.217 14.908 1.00 40.23 H new ATOM 0 HD13 ILE A 27 -3.621 -21.615 15.139 1.00 40.23 H new ATOM 428 N HIS A 28 -1.955 -25.056 12.785 1.00 60.22 N ATOM 429 CA HIS A 28 -1.483 -26.286 12.159 1.00 62.14 C ATOM 430 C HIS A 28 -2.649 -27.090 11.592 1.00 54.42 C ATOM 431 O HIS A 28 -3.579 -27.448 12.315 1.00 34.54 O ATOM 432 CB HIS A 28 -0.708 -27.133 13.169 1.00 52.21 C ATOM 433 CG HIS A 28 0.382 -27.954 12.551 1.00 12.25 C ATOM 434 ND1 HIS A 28 0.275 -29.313 12.345 1.00 42.13 N ATOM 435 CD2 HIS A 28 1.605 -27.600 12.093 1.00 3.12 C ATOM 436 CE1 HIS A 28 1.387 -29.760 11.788 1.00 55.24 C ATOM 437 NE2 HIS A 28 2.210 -28.740 11.624 1.00 72.01 N ATOM 0 H HIS A 28 -2.292 -25.172 13.741 1.00 60.22 H new ATOM 0 HA HIS A 28 -0.819 -26.014 11.338 1.00 62.14 H new ATOM 0 HB2 HIS A 28 -0.274 -26.477 13.924 1.00 52.21 H new ATOM 0 HB3 HIS A 28 -1.403 -27.796 13.684 1.00 52.21 H new ATOM 0 HD2 HIS A 28 2.027 -26.606 12.096 1.00 3.12 H new ATOM 0 HE1 HIS A 28 1.589 -30.785 11.514 1.00 55.24 H new ATOM 0 HE2 HIS A 28 3.143 -28.791 11.215 1.00 72.01 H new ATOM 445 N LEU A 29 -2.594 -27.368 10.294 1.00 32.32 N ATOM 446 CA LEU A 29 -3.647 -28.129 9.630 1.00 63.14 C ATOM 447 C LEU A 29 -3.060 -29.297 8.843 1.00 35.44 C ATOM 448 O LEU A 29 -1.856 -29.551 8.892 1.00 34.40 O ATOM 449 CB LEU A 29 -4.447 -27.221 8.694 1.00 0.35 C ATOM 450 CG LEU A 29 -4.907 -25.888 9.285 1.00 10.53 C ATOM 451 CD1 LEU A 29 -5.536 -25.016 8.210 1.00 51.33 C ATOM 452 CD2 LEU A 29 -5.886 -26.120 10.427 1.00 54.33 C ATOM 0 H LEU A 29 -1.832 -27.078 9.681 1.00 32.32 H new ATOM 0 HA LEU A 29 -4.312 -28.527 10.396 1.00 63.14 H new ATOM 0 HB2 LEU A 29 -3.839 -27.015 7.813 1.00 0.35 H new ATOM 0 HB3 LEU A 29 -5.326 -27.768 8.354 1.00 0.35 H new ATOM 0 HG LEU A 29 -4.035 -25.368 9.681 1.00 10.53 H new ATOM 0 HD11 LEU A 29 -5.857 -24.072 8.649 1.00 51.33 H new ATOM 0 HD12 LEU A 29 -4.805 -24.821 7.426 1.00 51.33 H new ATOM 0 HD13 LEU A 29 -6.398 -25.529 7.783 1.00 51.33 H new ATOM 0 HD21 LEU A 29 -6.203 -25.160 10.835 1.00 54.33 H new ATOM 0 HD22 LEU A 29 -6.756 -26.661 10.056 1.00 54.33 H new ATOM 0 HD23 LEU A 29 -5.401 -26.705 11.209 1.00 54.33 H new ATOM 464 N THR A 30 -3.920 -30.005 8.117 1.00 65.44 N ATOM 465 CA THR A 30 -3.487 -31.146 7.319 1.00 54.01 C ATOM 466 C THR A 30 -3.462 -30.801 5.834 1.00 3.54 C ATOM 467 O THR A 30 -3.800 -29.685 5.441 1.00 74.34 O ATOM 468 CB THR A 30 -4.406 -32.363 7.535 1.00 31.32 C ATOM 469 OG1 THR A 30 -3.819 -33.531 6.950 1.00 43.42 O ATOM 470 CG2 THR A 30 -5.779 -32.120 6.926 1.00 22.31 C ATOM 0 H THR A 30 -4.920 -29.809 8.065 1.00 65.44 H new ATOM 0 HA THR A 30 -2.479 -31.397 7.648 1.00 54.01 H new ATOM 0 HB THR A 30 -4.524 -32.515 8.608 1.00 31.32 H new ATOM 0 HG1 THR A 30 -4.409 -34.300 7.093 1.00 43.42 H new ATOM 0 HG21 THR A 30 -6.410 -32.993 7.091 1.00 22.31 H new ATOM 0 HG22 THR A 30 -6.236 -31.248 7.395 1.00 22.31 H new ATOM 0 HG23 THR A 30 -5.676 -31.944 5.855 1.00 22.31 H new ATOM 478 N GLY A 31 -3.058 -31.766 5.014 1.00 40.44 N ATOM 479 CA GLY A 31 -2.996 -31.543 3.581 1.00 73.32 C ATOM 480 C GLY A 31 -4.332 -31.119 3.002 1.00 65.31 C ATOM 481 O GLY A 31 -4.424 -30.103 2.313 1.00 62.23 O ATOM 0 H GLY A 31 -2.773 -32.698 5.316 1.00 40.44 H new ATOM 0 HA2 GLY A 31 -2.251 -30.776 3.368 1.00 73.32 H new ATOM 0 HA3 GLY A 31 -2.663 -32.457 3.088 1.00 73.32 H new ATOM 485 N LYS A 32 -5.370 -31.900 3.280 1.00 10.03 N ATOM 486 CA LYS A 32 -6.708 -31.601 2.783 1.00 64.24 C ATOM 487 C LYS A 32 -7.150 -30.207 3.216 1.00 75.34 C ATOM 488 O LYS A 32 -7.543 -29.386 2.387 1.00 23.33 O ATOM 489 CB LYS A 32 -7.707 -32.645 3.287 1.00 63.01 C ATOM 490 CG LYS A 32 -7.789 -33.882 2.409 1.00 13.21 C ATOM 491 CD LYS A 32 -6.441 -34.573 2.291 1.00 33.13 C ATOM 492 CE LYS A 32 -6.554 -35.889 1.537 1.00 42.13 C ATOM 493 NZ LYS A 32 -5.252 -36.610 1.483 1.00 72.34 N ATOM 0 H LYS A 32 -5.311 -32.746 3.847 1.00 10.03 H new ATOM 0 HA LYS A 32 -6.679 -31.632 1.694 1.00 64.24 H new ATOM 0 HB2 LYS A 32 -7.428 -32.945 4.297 1.00 63.01 H new ATOM 0 HB3 LYS A 32 -8.695 -32.189 3.351 1.00 63.01 H new ATOM 0 HG2 LYS A 32 -8.519 -34.576 2.824 1.00 13.21 H new ATOM 0 HG3 LYS A 32 -8.143 -33.602 1.417 1.00 13.21 H new ATOM 0 HD2 LYS A 32 -5.738 -33.917 1.777 1.00 33.13 H new ATOM 0 HD3 LYS A 32 -6.036 -34.756 3.286 1.00 33.13 H new ATOM 0 HE2 LYS A 32 -7.300 -36.521 2.019 1.00 42.13 H new ATOM 0 HE3 LYS A 32 -6.906 -35.698 0.523 1.00 42.13 H new ATOM 0 HZ1 LYS A 32 -5.370 -37.502 0.961 1.00 72.34 H new ATOM 0 HZ2 LYS A 32 -4.547 -36.017 1.000 1.00 72.34 H new ATOM 0 HZ3 LYS A 32 -4.928 -36.815 2.450 1.00 72.34 H new ATOM 507 N GLU A 33 -7.083 -29.948 4.518 1.00 55.33 N ATOM 508 CA GLU A 33 -7.477 -28.652 5.059 1.00 74.31 C ATOM 509 C GLU A 33 -6.654 -27.529 4.435 1.00 55.12 C ATOM 510 O GLU A 33 -7.177 -26.455 4.134 1.00 22.15 O ATOM 511 CB GLU A 33 -7.310 -28.638 6.580 1.00 41.33 C ATOM 512 CG GLU A 33 -8.125 -29.704 7.292 1.00 13.31 C ATOM 513 CD GLU A 33 -7.793 -29.802 8.768 1.00 35.44 C ATOM 514 OE1 GLU A 33 -6.644 -29.485 9.140 1.00 11.00 O ATOM 515 OE2 GLU A 33 -8.682 -30.197 9.552 1.00 71.12 O ATOM 0 H GLU A 33 -6.760 -30.617 5.217 1.00 55.33 H new ATOM 0 HA GLU A 33 -8.527 -28.488 4.814 1.00 74.31 H new ATOM 0 HB2 GLU A 33 -6.256 -28.776 6.823 1.00 41.33 H new ATOM 0 HB3 GLU A 33 -7.599 -27.658 6.960 1.00 41.33 H new ATOM 0 HG2 GLU A 33 -9.186 -29.483 7.176 1.00 13.31 H new ATOM 0 HG3 GLU A 33 -7.947 -30.669 6.818 1.00 13.31 H new ATOM 522 N TYR A 34 -5.365 -27.784 4.243 1.00 31.43 N ATOM 523 CA TYR A 34 -4.468 -26.795 3.658 1.00 15.31 C ATOM 524 C TYR A 34 -4.840 -26.515 2.205 1.00 63.00 C ATOM 525 O TYR A 34 -4.678 -25.397 1.715 1.00 73.44 O ATOM 526 CB TYR A 34 -3.019 -27.276 3.742 1.00 10.13 C ATOM 527 CG TYR A 34 -2.300 -26.815 4.990 1.00 64.40 C ATOM 528 CD1 TYR A 34 -2.253 -25.469 5.332 1.00 73.42 C ATOM 529 CD2 TYR A 34 -1.666 -27.726 5.826 1.00 5.23 C ATOM 530 CE1 TYR A 34 -1.597 -25.044 6.470 1.00 3.24 C ATOM 531 CE2 TYR A 34 -1.008 -27.309 6.967 1.00 21.45 C ATOM 532 CZ TYR A 34 -0.976 -25.968 7.285 1.00 10.51 C ATOM 533 OH TYR A 34 -0.321 -25.549 8.420 1.00 3.43 O ATOM 0 H TYR A 34 -4.917 -28.668 4.484 1.00 31.43 H new ATOM 0 HA TYR A 34 -4.569 -25.870 4.225 1.00 15.31 H new ATOM 0 HB2 TYR A 34 -3.004 -28.365 3.705 1.00 10.13 H new ATOM 0 HB3 TYR A 34 -2.475 -26.920 2.867 1.00 10.13 H new ATOM 0 HD1 TYR A 34 -2.738 -24.743 4.697 1.00 73.42 H new ATOM 0 HD2 TYR A 34 -1.688 -28.777 5.580 1.00 5.23 H new ATOM 0 HE1 TYR A 34 -1.570 -23.994 6.721 1.00 3.24 H new ATOM 0 HE2 TYR A 34 -0.521 -28.030 7.607 1.00 21.45 H new ATOM 0 HH TYR A 34 0.061 -26.324 8.882 1.00 3.43 H new ATOM 543 N VAL A 35 -5.339 -27.540 1.521 1.00 41.41 N ATOM 544 CA VAL A 35 -5.736 -27.406 0.124 1.00 5.32 C ATOM 545 C VAL A 35 -6.998 -26.561 -0.010 1.00 62.51 C ATOM 546 O VAL A 35 -7.136 -25.776 -0.949 1.00 3.23 O ATOM 547 CB VAL A 35 -5.980 -28.781 -0.524 1.00 63.32 C ATOM 548 CG1 VAL A 35 -6.809 -28.635 -1.791 1.00 44.02 C ATOM 549 CG2 VAL A 35 -4.657 -29.473 -0.819 1.00 74.03 C ATOM 0 H VAL A 35 -5.478 -28.472 1.911 1.00 41.41 H new ATOM 0 HA VAL A 35 -4.914 -26.910 -0.393 1.00 5.32 H new ATOM 0 HB VAL A 35 -6.539 -29.400 0.178 1.00 63.32 H new ATOM 0 HG11 VAL A 35 -6.971 -29.617 -2.235 1.00 44.02 H new ATOM 0 HG12 VAL A 35 -7.771 -28.184 -1.547 1.00 44.02 H new ATOM 0 HG13 VAL A 35 -6.280 -27.999 -2.501 1.00 44.02 H new ATOM 0 HG21 VAL A 35 -4.848 -30.444 -1.277 1.00 74.03 H new ATOM 0 HG22 VAL A 35 -4.070 -28.859 -1.502 1.00 74.03 H new ATOM 0 HG23 VAL A 35 -4.104 -29.613 0.110 1.00 74.03 H new ATOM 559 N LEU A 36 -7.917 -26.728 0.934 1.00 13.11 N ATOM 560 CA LEU A 36 -9.170 -25.980 0.922 1.00 20.45 C ATOM 561 C LEU A 36 -8.948 -24.539 1.369 1.00 11.04 C ATOM 562 O LEU A 36 -9.620 -23.621 0.897 1.00 11.14 O ATOM 563 CB LEU A 36 -10.198 -26.656 1.832 1.00 52.34 C ATOM 564 CG LEU A 36 -11.059 -27.740 1.182 1.00 24.32 C ATOM 565 CD1 LEU A 36 -10.197 -28.914 0.744 1.00 63.03 C ATOM 566 CD2 LEU A 36 -12.146 -28.203 2.141 1.00 70.43 C ATOM 0 H LEU A 36 -7.819 -27.374 1.717 1.00 13.11 H new ATOM 0 HA LEU A 36 -9.549 -25.969 -0.100 1.00 20.45 H new ATOM 0 HB2 LEU A 36 -9.671 -27.097 2.678 1.00 52.34 H new ATOM 0 HB3 LEU A 36 -10.859 -25.888 2.234 1.00 52.34 H new ATOM 0 HG LEU A 36 -11.537 -27.317 0.299 1.00 24.32 H new ATOM 0 HD11 LEU A 36 -10.826 -29.676 0.284 1.00 63.03 H new ATOM 0 HD12 LEU A 36 -9.455 -28.572 0.022 1.00 63.03 H new ATOM 0 HD13 LEU A 36 -9.691 -29.337 1.612 1.00 63.03 H new ATOM 0 HD21 LEU A 36 -12.749 -28.974 1.662 1.00 70.43 H new ATOM 0 HD22 LEU A 36 -11.687 -28.609 3.043 1.00 70.43 H new ATOM 0 HD23 LEU A 36 -12.781 -27.358 2.406 1.00 70.43 H new ATOM 578 N LEU A 37 -8.000 -24.347 2.280 1.00 15.22 N ATOM 579 CA LEU A 37 -7.688 -23.016 2.790 1.00 64.22 C ATOM 580 C LEU A 37 -6.807 -22.250 1.808 1.00 71.23 C ATOM 581 O LEU A 37 -7.109 -21.114 1.445 1.00 12.21 O ATOM 582 CB LEU A 37 -6.988 -23.119 4.146 1.00 20.42 C ATOM 583 CG LEU A 37 -7.892 -23.027 5.376 1.00 4.12 C ATOM 584 CD1 LEU A 37 -8.598 -21.681 5.420 1.00 51.15 C ATOM 585 CD2 LEU A 37 -8.904 -24.163 5.381 1.00 60.00 C ATOM 0 H LEU A 37 -7.434 -25.095 2.680 1.00 15.22 H new ATOM 0 HA LEU A 37 -8.624 -22.472 2.912 1.00 64.22 H new ATOM 0 HB2 LEU A 37 -6.451 -24.067 4.184 1.00 20.42 H new ATOM 0 HB3 LEU A 37 -6.242 -22.327 4.208 1.00 20.42 H new ATOM 0 HG LEU A 37 -7.271 -23.117 6.267 1.00 4.12 H new ATOM 0 HD11 LEU A 37 -9.237 -21.634 6.302 1.00 51.15 H new ATOM 0 HD12 LEU A 37 -7.857 -20.883 5.465 1.00 51.15 H new ATOM 0 HD13 LEU A 37 -9.207 -21.560 4.524 1.00 51.15 H new ATOM 0 HD21 LEU A 37 -9.539 -24.081 6.263 1.00 60.00 H new ATOM 0 HD22 LEU A 37 -9.521 -24.105 4.484 1.00 60.00 H new ATOM 0 HD23 LEU A 37 -8.379 -25.118 5.399 1.00 60.00 H new ATOM 597 N GLU A 38 -5.718 -22.882 1.380 1.00 53.21 N ATOM 598 CA GLU A 38 -4.795 -22.259 0.438 1.00 32.24 C ATOM 599 C GLU A 38 -5.540 -21.730 -0.784 1.00 4.41 C ATOM 600 O GLU A 38 -5.195 -20.679 -1.328 1.00 72.50 O ATOM 601 CB GLU A 38 -3.724 -23.261 0.002 1.00 1.12 C ATOM 602 CG GLU A 38 -4.242 -24.333 -0.941 1.00 65.35 C ATOM 603 CD GLU A 38 -3.186 -25.365 -1.287 1.00 63.41 C ATOM 604 OE1 GLU A 38 -2.681 -26.031 -0.358 1.00 40.34 O ATOM 605 OE2 GLU A 38 -2.864 -25.508 -2.485 1.00 40.41 O ATOM 0 H GLU A 38 -5.454 -23.823 1.670 1.00 53.21 H new ATOM 0 HA GLU A 38 -4.314 -21.420 0.940 1.00 32.24 H new ATOM 0 HB2 GLU A 38 -2.911 -22.722 -0.485 1.00 1.12 H new ATOM 0 HB3 GLU A 38 -3.304 -23.739 0.887 1.00 1.12 H new ATOM 0 HG2 GLU A 38 -5.096 -24.832 -0.484 1.00 65.35 H new ATOM 0 HG3 GLU A 38 -4.600 -23.864 -1.857 1.00 65.35 H new ATOM 612 N LEU A 39 -6.561 -22.464 -1.211 1.00 12.42 N ATOM 613 CA LEU A 39 -7.355 -22.069 -2.369 1.00 72.33 C ATOM 614 C LEU A 39 -8.360 -20.984 -1.997 1.00 2.50 C ATOM 615 O LEU A 39 -8.534 -20.007 -2.727 1.00 71.14 O ATOM 616 CB LEU A 39 -8.088 -23.282 -2.947 1.00 0.34 C ATOM 617 CG LEU A 39 -8.310 -23.274 -4.459 1.00 60.05 C ATOM 618 CD1 LEU A 39 -6.979 -23.269 -5.194 1.00 45.13 C ATOM 619 CD2 LEU A 39 -9.150 -24.471 -4.881 1.00 65.04 C ATOM 0 H LEU A 39 -6.859 -23.336 -0.773 1.00 12.42 H new ATOM 0 HA LEU A 39 -6.678 -21.667 -3.123 1.00 72.33 H new ATOM 0 HB2 LEU A 39 -7.526 -24.179 -2.687 1.00 0.34 H new ATOM 0 HB3 LEU A 39 -9.059 -23.362 -2.458 1.00 0.34 H new ATOM 0 HG LEU A 39 -8.850 -22.365 -4.723 1.00 60.05 H new ATOM 0 HD11 LEU A 39 -7.157 -23.263 -6.269 1.00 45.13 H new ATOM 0 HD12 LEU A 39 -6.413 -22.380 -4.915 1.00 45.13 H new ATOM 0 HD13 LEU A 39 -6.411 -24.160 -4.925 1.00 45.13 H new ATOM 0 HD21 LEU A 39 -9.298 -24.449 -5.961 1.00 65.04 H new ATOM 0 HD22 LEU A 39 -8.637 -25.392 -4.604 1.00 65.04 H new ATOM 0 HD23 LEU A 39 -10.118 -24.431 -4.381 1.00 65.04 H new ATOM 631 N LEU A 40 -9.017 -21.159 -0.856 1.00 3.02 N ATOM 632 CA LEU A 40 -10.003 -20.193 -0.384 1.00 42.23 C ATOM 633 C LEU A 40 -9.374 -18.814 -0.211 1.00 54.33 C ATOM 634 O LEU A 40 -9.909 -17.812 -0.688 1.00 51.33 O ATOM 635 CB LEU A 40 -10.610 -20.659 0.940 1.00 1.01 C ATOM 636 CG LEU A 40 -12.005 -21.280 0.857 1.00 2.34 C ATOM 637 CD1 LEU A 40 -13.042 -20.219 0.523 1.00 70.14 C ATOM 638 CD2 LEU A 40 -12.031 -22.398 -0.174 1.00 63.03 C ATOM 0 H LEU A 40 -8.885 -21.961 -0.240 1.00 3.02 H new ATOM 0 HA LEU A 40 -10.792 -20.121 -1.132 1.00 42.23 H new ATOM 0 HB2 LEU A 40 -9.936 -21.388 1.389 1.00 1.01 H new ATOM 0 HB3 LEU A 40 -10.654 -19.806 1.617 1.00 1.01 H new ATOM 0 HG LEU A 40 -12.251 -21.705 1.830 1.00 2.34 H new ATOM 0 HD11 LEU A 40 -14.029 -20.679 0.468 1.00 70.14 H new ATOM 0 HD12 LEU A 40 -13.042 -19.453 1.298 1.00 70.14 H new ATOM 0 HD13 LEU A 40 -12.800 -19.763 -0.437 1.00 70.14 H new ATOM 0 HD21 LEU A 40 -13.032 -22.828 -0.219 1.00 63.03 H new ATOM 0 HD22 LEU A 40 -11.764 -21.997 -1.152 1.00 63.03 H new ATOM 0 HD23 LEU A 40 -11.316 -23.171 0.109 1.00 63.03 H new ATOM 650 N LEU A 41 -8.236 -18.770 0.472 1.00 40.42 N ATOM 651 CA LEU A 41 -7.532 -17.513 0.706 1.00 34.30 C ATOM 652 C LEU A 41 -6.948 -16.966 -0.592 1.00 61.33 C ATOM 653 O LEU A 41 -7.024 -15.768 -0.861 1.00 43.20 O ATOM 654 CB LEU A 41 -6.419 -17.714 1.735 1.00 2.14 C ATOM 655 CG LEU A 41 -5.314 -18.696 1.346 1.00 64.22 C ATOM 656 CD1 LEU A 41 -4.155 -17.963 0.689 1.00 42.33 C ATOM 657 CD2 LEU A 41 -4.834 -19.471 2.565 1.00 54.31 C ATOM 0 H LEU A 41 -7.781 -19.590 0.874 1.00 40.42 H new ATOM 0 HA LEU A 41 -8.250 -16.789 1.093 1.00 34.30 H new ATOM 0 HB2 LEU A 41 -5.962 -16.746 1.939 1.00 2.14 H new ATOM 0 HB3 LEU A 41 -6.870 -18.056 2.666 1.00 2.14 H new ATOM 0 HG LEU A 41 -5.723 -19.406 0.627 1.00 64.22 H new ATOM 0 HD11 LEU A 41 -3.378 -18.678 0.419 1.00 42.33 H new ATOM 0 HD12 LEU A 41 -4.508 -17.455 -0.208 1.00 42.33 H new ATOM 0 HD13 LEU A 41 -3.747 -17.230 1.385 1.00 42.33 H new ATOM 0 HD21 LEU A 41 -4.048 -20.165 2.268 1.00 54.31 H new ATOM 0 HD22 LEU A 41 -4.443 -18.775 3.308 1.00 54.31 H new ATOM 0 HD23 LEU A 41 -5.667 -20.028 2.993 1.00 54.31 H new ATOM 669 N GLN A 42 -6.367 -17.853 -1.394 1.00 33.42 N ATOM 670 CA GLN A 42 -5.771 -17.459 -2.665 1.00 15.22 C ATOM 671 C GLN A 42 -6.763 -16.663 -3.507 1.00 0.31 C ATOM 672 O GLN A 42 -6.420 -15.622 -4.069 1.00 30.32 O ATOM 673 CB GLN A 42 -5.303 -18.693 -3.438 1.00 34.02 C ATOM 674 CG GLN A 42 -4.804 -18.380 -4.839 1.00 72.12 C ATOM 675 CD GLN A 42 -4.466 -19.628 -5.630 1.00 61.24 C ATOM 676 OE1 GLN A 42 -4.606 -20.747 -5.136 1.00 60.44 O ATOM 677 NE2 GLN A 42 -4.018 -19.442 -6.866 1.00 63.45 N ATOM 0 H GLN A 42 -6.296 -18.849 -1.186 1.00 33.42 H new ATOM 0 HA GLN A 42 -4.910 -16.825 -2.453 1.00 15.22 H new ATOM 0 HB2 GLN A 42 -4.506 -19.181 -2.878 1.00 34.02 H new ATOM 0 HB3 GLN A 42 -6.127 -19.404 -3.505 1.00 34.02 H new ATOM 0 HG2 GLN A 42 -5.565 -17.811 -5.373 1.00 72.12 H new ATOM 0 HG3 GLN A 42 -3.920 -17.746 -4.773 1.00 72.12 H new ATOM 0 HE21 GLN A 42 -3.917 -18.496 -7.235 1.00 63.45 H new ATOM 0 HE22 GLN A 42 -3.774 -20.245 -7.446 1.00 63.45 H new ATOM 686 N ARG A 43 -7.993 -17.159 -3.590 1.00 51.32 N ATOM 687 CA ARG A 43 -9.034 -16.494 -4.365 1.00 60.22 C ATOM 688 C ARG A 43 -10.014 -15.768 -3.449 1.00 33.02 C ATOM 689 O ARG A 43 -11.167 -15.535 -3.814 1.00 12.00 O ATOM 690 CB ARG A 43 -9.784 -17.510 -5.229 1.00 24.31 C ATOM 691 CG ARG A 43 -8.879 -18.311 -6.151 1.00 23.43 C ATOM 692 CD ARG A 43 -8.044 -17.403 -7.040 1.00 11.34 C ATOM 693 NE ARG A 43 -8.873 -16.605 -7.939 1.00 72.34 N ATOM 694 CZ ARG A 43 -9.377 -17.068 -9.078 1.00 34.22 C ATOM 695 NH1 ARG A 43 -9.138 -18.317 -9.453 1.00 73.12 N ATOM 696 NH2 ARG A 43 -10.123 -16.281 -9.843 1.00 61.31 N ATOM 0 H ARG A 43 -8.293 -18.019 -3.130 1.00 51.32 H new ATOM 0 HA ARG A 43 -8.556 -15.759 -5.013 1.00 60.22 H new ATOM 0 HB2 ARG A 43 -10.326 -18.197 -4.579 1.00 24.31 H new ATOM 0 HB3 ARG A 43 -10.527 -16.985 -5.829 1.00 24.31 H new ATOM 0 HG2 ARG A 43 -8.221 -18.945 -5.556 1.00 23.43 H new ATOM 0 HG3 ARG A 43 -9.484 -18.973 -6.771 1.00 23.43 H new ATOM 0 HD2 ARG A 43 -7.442 -16.740 -6.418 1.00 11.34 H new ATOM 0 HD3 ARG A 43 -7.351 -18.007 -7.626 1.00 11.34 H new ATOM 0 HE ARG A 43 -9.076 -15.640 -7.679 1.00 72.34 H new ATOM 0 HH11 ARG A 43 -8.566 -18.925 -8.867 1.00 73.12 H new ATOM 0 HH12 ARG A 43 -9.526 -18.670 -10.328 1.00 73.12 H new ATOM 0 HH21 ARG A 43 -10.310 -15.320 -9.557 1.00 61.31 H new ATOM 0 HH22 ARG A 43 -10.509 -16.637 -10.717 1.00 61.31 H new ATOM 710 N THR A 44 -9.549 -15.413 -2.255 1.00 43.43 N ATOM 711 CA THR A 44 -10.384 -14.715 -1.286 1.00 3.21 C ATOM 712 C THR A 44 -11.053 -13.497 -1.912 1.00 45.42 C ATOM 713 O THR A 44 -10.424 -12.745 -2.657 1.00 30.44 O ATOM 714 CB THR A 44 -9.566 -14.264 -0.061 1.00 23.20 C ATOM 715 OG1 THR A 44 -10.426 -13.647 0.903 1.00 52.13 O ATOM 716 CG2 THR A 44 -8.472 -13.289 -0.470 1.00 22.22 C ATOM 0 H THR A 44 -8.598 -15.598 -1.936 1.00 43.43 H new ATOM 0 HA THR A 44 -11.150 -15.421 -0.963 1.00 3.21 H new ATOM 0 HB THR A 44 -9.100 -15.145 0.381 1.00 23.20 H new ATOM 0 HG1 THR A 44 -9.898 -13.365 1.679 1.00 52.13 H new ATOM 0 HG21 THR A 44 -7.908 -12.985 0.412 1.00 22.22 H new ATOM 0 HG22 THR A 44 -7.802 -13.772 -1.181 1.00 22.22 H new ATOM 0 HG23 THR A 44 -8.922 -12.411 -0.934 1.00 22.22 H new ATOM 724 N GLY A 45 -12.332 -13.306 -1.605 1.00 72.11 N ATOM 725 CA GLY A 45 -13.065 -12.176 -2.146 1.00 62.44 C ATOM 726 C GLY A 45 -14.018 -12.580 -3.254 1.00 23.32 C ATOM 727 O GLY A 45 -14.979 -11.869 -3.543 1.00 71.04 O ATOM 0 H GLY A 45 -12.874 -13.914 -0.991 1.00 72.11 H new ATOM 0 HA2 GLY A 45 -13.627 -11.694 -1.346 1.00 62.44 H new ATOM 0 HA3 GLY A 45 -12.359 -11.439 -2.529 1.00 62.44 H new ATOM 731 N GLU A 46 -13.750 -13.725 -3.875 1.00 44.53 N ATOM 732 CA GLU A 46 -14.590 -14.220 -4.959 1.00 52.41 C ATOM 733 C GLU A 46 -14.986 -15.674 -4.720 1.00 1.21 C ATOM 734 O GLU A 46 -14.207 -16.460 -4.180 1.00 74.24 O ATOM 735 CB GLU A 46 -13.862 -14.091 -6.299 1.00 23.54 C ATOM 736 CG GLU A 46 -12.450 -14.653 -6.280 1.00 2.44 C ATOM 737 CD GLU A 46 -11.912 -14.927 -7.671 1.00 13.22 C ATOM 738 OE1 GLU A 46 -12.467 -15.808 -8.359 1.00 35.41 O ATOM 739 OE2 GLU A 46 -10.936 -14.259 -8.071 1.00 41.41 O ATOM 0 H GLU A 46 -12.959 -14.326 -3.646 1.00 44.53 H new ATOM 0 HA GLU A 46 -15.496 -13.615 -4.987 1.00 52.41 H new ATOM 0 HB2 GLU A 46 -14.439 -14.606 -7.068 1.00 23.54 H new ATOM 0 HB3 GLU A 46 -13.822 -13.039 -6.582 1.00 23.54 H new ATOM 0 HG2 GLU A 46 -11.790 -13.950 -5.771 1.00 2.44 H new ATOM 0 HG3 GLU A 46 -12.438 -15.577 -5.702 1.00 2.44 H new ATOM 746 N VAL A 47 -16.203 -16.024 -5.125 1.00 24.20 N ATOM 747 CA VAL A 47 -16.703 -17.383 -4.956 1.00 22.32 C ATOM 748 C VAL A 47 -16.158 -18.308 -6.038 1.00 62.13 C ATOM 749 O VAL A 47 -16.355 -18.070 -7.231 1.00 34.53 O ATOM 750 CB VAL A 47 -18.242 -17.423 -4.989 1.00 51.02 C ATOM 751 CG1 VAL A 47 -18.749 -18.805 -4.607 1.00 32.12 C ATOM 752 CG2 VAL A 47 -18.822 -16.360 -4.069 1.00 12.22 C ATOM 0 H VAL A 47 -16.860 -15.385 -5.572 1.00 24.20 H new ATOM 0 HA VAL A 47 -16.359 -17.728 -3.981 1.00 22.32 H new ATOM 0 HB VAL A 47 -18.572 -17.210 -6.006 1.00 51.02 H new ATOM 0 HG11 VAL A 47 -19.839 -18.814 -4.636 1.00 32.12 H new ATOM 0 HG12 VAL A 47 -18.361 -19.542 -5.310 1.00 32.12 H new ATOM 0 HG13 VAL A 47 -18.411 -19.051 -3.600 1.00 32.12 H new ATOM 0 HG21 VAL A 47 -19.911 -16.403 -4.105 1.00 12.22 H new ATOM 0 HG22 VAL A 47 -18.485 -16.539 -3.048 1.00 12.22 H new ATOM 0 HG23 VAL A 47 -18.487 -15.375 -4.394 1.00 12.22 H new ATOM 762 N LEU A 48 -15.471 -19.364 -5.616 1.00 34.11 N ATOM 763 CA LEU A 48 -14.897 -20.327 -6.549 1.00 53.14 C ATOM 764 C LEU A 48 -15.626 -21.665 -6.469 1.00 1.44 C ATOM 765 O LEU A 48 -16.275 -21.987 -5.473 1.00 44.11 O ATOM 766 CB LEU A 48 -13.409 -20.525 -6.257 1.00 70.32 C ATOM 767 CG LEU A 48 -13.007 -20.509 -4.782 1.00 45.32 C ATOM 768 CD1 LEU A 48 -11.788 -21.389 -4.551 1.00 43.54 C ATOM 769 CD2 LEU A 48 -12.734 -19.085 -4.320 1.00 1.22 C ATOM 0 H LEU A 48 -15.298 -19.575 -4.633 1.00 34.11 H new ATOM 0 HA LEU A 48 -15.013 -19.931 -7.558 1.00 53.14 H new ATOM 0 HB2 LEU A 48 -13.098 -21.477 -6.687 1.00 70.32 H new ATOM 0 HB3 LEU A 48 -12.851 -19.744 -6.774 1.00 70.32 H new ATOM 0 HG LEU A 48 -13.834 -20.909 -4.195 1.00 45.32 H new ATOM 0 HD11 LEU A 48 -11.517 -21.365 -3.496 1.00 43.54 H new ATOM 0 HD12 LEU A 48 -12.018 -22.414 -4.843 1.00 43.54 H new ATOM 0 HD13 LEU A 48 -10.954 -21.020 -5.148 1.00 43.54 H new ATOM 0 HD21 LEU A 48 -12.449 -19.092 -3.268 1.00 1.22 H new ATOM 0 HD22 LEU A 48 -11.924 -18.659 -4.912 1.00 1.22 H new ATOM 0 HD23 LEU A 48 -13.633 -18.482 -4.448 1.00 1.22 H new ATOM 781 N PRO A 49 -15.516 -22.464 -7.540 1.00 21.32 N ATOM 782 CA PRO A 49 -16.155 -23.781 -7.613 1.00 71.44 C ATOM 783 C PRO A 49 -15.511 -24.792 -6.671 1.00 2.03 C ATOM 784 O PRO A 49 -14.330 -24.681 -6.340 1.00 71.41 O ATOM 785 CB PRO A 49 -15.942 -24.198 -9.071 1.00 30.22 C ATOM 786 CG PRO A 49 -14.728 -23.451 -9.505 1.00 33.22 C ATOM 787 CD PRO A 49 -14.759 -22.144 -8.762 1.00 25.45 C ATOM 0 HA PRO A 49 -17.203 -23.742 -7.314 1.00 71.44 H new ATOM 0 HB2 PRO A 49 -15.796 -25.275 -9.158 1.00 30.22 H new ATOM 0 HB3 PRO A 49 -16.805 -23.943 -9.686 1.00 30.22 H new ATOM 0 HG2 PRO A 49 -13.822 -24.010 -9.273 1.00 33.22 H new ATOM 0 HG3 PRO A 49 -14.735 -23.288 -10.583 1.00 33.22 H new ATOM 0 HD2 PRO A 49 -13.755 -21.789 -8.531 1.00 25.45 H new ATOM 0 HD3 PRO A 49 -15.247 -21.362 -9.344 1.00 25.45 H new ATOM 795 N ARG A 50 -16.293 -25.777 -6.242 1.00 14.44 N ATOM 796 CA ARG A 50 -15.799 -26.807 -5.336 1.00 44.51 C ATOM 797 C ARG A 50 -14.989 -27.854 -6.095 1.00 3.14 C ATOM 798 O ARG A 50 -14.062 -28.452 -5.548 1.00 41.00 O ATOM 799 CB ARG A 50 -16.964 -27.477 -4.607 1.00 31.32 C ATOM 800 CG ARG A 50 -16.560 -28.713 -3.820 1.00 22.31 C ATOM 801 CD ARG A 50 -17.695 -29.208 -2.938 1.00 33.22 C ATOM 802 NE ARG A 50 -18.964 -29.264 -3.659 1.00 20.50 N ATOM 803 CZ ARG A 50 -20.149 -29.291 -3.060 1.00 13.11 C ATOM 804 NH1 ARG A 50 -20.228 -29.266 -1.737 1.00 3.14 N ATOM 805 NH2 ARG A 50 -21.259 -29.342 -3.785 1.00 15.11 N ATOM 0 H ARG A 50 -17.272 -25.884 -6.507 1.00 14.44 H new ATOM 0 HA ARG A 50 -15.148 -26.330 -4.603 1.00 44.51 H new ATOM 0 HB2 ARG A 50 -17.419 -26.756 -3.927 1.00 31.32 H new ATOM 0 HB3 ARG A 50 -17.726 -27.753 -5.335 1.00 31.32 H new ATOM 0 HG2 ARG A 50 -16.262 -29.503 -4.509 1.00 22.31 H new ATOM 0 HG3 ARG A 50 -15.691 -28.485 -3.203 1.00 22.31 H new ATOM 0 HD2 ARG A 50 -17.451 -30.199 -2.556 1.00 33.22 H new ATOM 0 HD3 ARG A 50 -17.797 -28.550 -2.075 1.00 33.22 H new ATOM 0 HE ARG A 50 -18.939 -29.283 -4.679 1.00 20.50 H new ATOM 0 HH11 ARG A 50 -19.377 -29.226 -1.176 1.00 3.14 H new ATOM 0 HH12 ARG A 50 -21.140 -29.287 -1.280 1.00 3.14 H new ATOM 0 HH21 ARG A 50 -21.203 -29.361 -4.803 1.00 15.11 H new ATOM 0 HH22 ARG A 50 -22.169 -29.363 -3.324 1.00 15.11 H new ATOM 819 N SER A 51 -15.346 -28.071 -7.356 1.00 44.25 N ATOM 820 CA SER A 51 -14.655 -29.049 -8.189 1.00 12.11 C ATOM 821 C SER A 51 -13.148 -28.811 -8.170 1.00 33.43 C ATOM 822 O SER A 51 -12.366 -29.730 -7.920 1.00 12.30 O ATOM 823 CB SER A 51 -15.175 -28.984 -9.626 1.00 61.14 C ATOM 824 OG SER A 51 -15.174 -27.652 -10.110 1.00 3.04 O ATOM 0 H SER A 51 -16.110 -27.583 -7.824 1.00 44.25 H new ATOM 0 HA SER A 51 -14.854 -30.041 -7.783 1.00 12.11 H new ATOM 0 HB2 SER A 51 -14.554 -29.608 -10.269 1.00 61.14 H new ATOM 0 HB3 SER A 51 -16.186 -29.389 -9.669 1.00 61.14 H new ATOM 0 HG SER A 51 -15.509 -27.638 -11.031 1.00 3.04 H new ATOM 830 N LEU A 52 -12.748 -27.573 -8.435 1.00 43.03 N ATOM 831 CA LEU A 52 -11.334 -27.212 -8.449 1.00 72.50 C ATOM 832 C LEU A 52 -10.650 -27.642 -7.155 1.00 70.22 C ATOM 833 O LEU A 52 -9.623 -28.322 -7.181 1.00 14.34 O ATOM 834 CB LEU A 52 -11.174 -25.704 -8.647 1.00 72.13 C ATOM 835 CG LEU A 52 -9.744 -25.202 -8.848 1.00 51.53 C ATOM 836 CD1 LEU A 52 -9.062 -25.967 -9.972 1.00 32.14 C ATOM 837 CD2 LEU A 52 -9.740 -23.708 -9.139 1.00 43.21 C ATOM 0 H LEU A 52 -13.382 -26.802 -8.643 1.00 43.03 H new ATOM 0 HA LEU A 52 -10.859 -27.733 -9.280 1.00 72.50 H new ATOM 0 HB2 LEU A 52 -11.767 -25.406 -9.512 1.00 72.13 H new ATOM 0 HB3 LEU A 52 -11.597 -25.197 -7.780 1.00 72.13 H new ATOM 0 HG LEU A 52 -9.186 -25.375 -7.928 1.00 51.53 H new ATOM 0 HD11 LEU A 52 -8.045 -25.596 -10.100 1.00 32.14 H new ATOM 0 HD12 LEU A 52 -9.032 -27.028 -9.724 1.00 32.14 H new ATOM 0 HD13 LEU A 52 -9.619 -25.826 -10.898 1.00 32.14 H new ATOM 0 HD21 LEU A 52 -8.714 -23.367 -9.279 1.00 43.21 H new ATOM 0 HD22 LEU A 52 -10.314 -23.512 -10.044 1.00 43.21 H new ATOM 0 HD23 LEU A 52 -10.189 -23.173 -8.302 1.00 43.21 H new ATOM 849 N ILE A 53 -11.227 -27.243 -6.027 1.00 24.55 N ATOM 850 CA ILE A 53 -10.674 -27.590 -4.723 1.00 71.31 C ATOM 851 C ILE A 53 -10.428 -29.091 -4.612 1.00 61.11 C ATOM 852 O ILE A 53 -9.321 -29.527 -4.296 1.00 71.30 O ATOM 853 CB ILE A 53 -11.607 -27.149 -3.580 1.00 55.34 C ATOM 854 CG1 ILE A 53 -11.857 -25.641 -3.650 1.00 40.23 C ATOM 855 CG2 ILE A 53 -11.013 -27.531 -2.233 1.00 42.21 C ATOM 856 CD1 ILE A 53 -13.112 -25.202 -2.929 1.00 53.03 C ATOM 0 H ILE A 53 -12.076 -26.680 -5.989 1.00 24.55 H new ATOM 0 HA ILE A 53 -9.726 -27.061 -4.632 1.00 71.31 H new ATOM 0 HB ILE A 53 -12.562 -27.663 -3.692 1.00 55.34 H new ATOM 0 HG12 ILE A 53 -11.001 -25.119 -3.223 1.00 40.23 H new ATOM 0 HG13 ILE A 53 -11.924 -25.340 -4.696 1.00 40.23 H new ATOM 0 HG21 ILE A 53 -11.684 -27.212 -1.436 1.00 42.21 H new ATOM 0 HG22 ILE A 53 -10.882 -28.612 -2.187 1.00 42.21 H new ATOM 0 HG23 ILE A 53 -10.046 -27.043 -2.110 1.00 42.21 H new ATOM 0 HD11 ILE A 53 -13.225 -24.122 -3.020 1.00 53.03 H new ATOM 0 HD12 ILE A 53 -13.977 -25.696 -3.371 1.00 53.03 H new ATOM 0 HD13 ILE A 53 -13.039 -25.471 -1.875 1.00 53.03 H new ATOM 868 N SER A 54 -11.467 -29.877 -4.876 1.00 10.10 N ATOM 869 CA SER A 54 -11.365 -31.330 -4.804 1.00 4.30 C ATOM 870 C SER A 54 -10.246 -31.841 -5.707 1.00 53.23 C ATOM 871 O SER A 54 -9.616 -32.858 -5.419 1.00 34.32 O ATOM 872 CB SER A 54 -12.693 -31.976 -5.202 1.00 22.10 C ATOM 873 OG SER A 54 -12.721 -33.347 -4.843 1.00 43.22 O ATOM 0 H SER A 54 -12.389 -29.532 -5.142 1.00 10.10 H new ATOM 0 HA SER A 54 -11.131 -31.603 -3.775 1.00 4.30 H new ATOM 0 HB2 SER A 54 -13.516 -31.453 -4.715 1.00 22.10 H new ATOM 0 HB3 SER A 54 -12.842 -31.875 -6.277 1.00 22.10 H new ATOM 0 HG SER A 54 -12.391 -33.888 -5.591 1.00 43.22 H new ATOM 879 N SER A 55 -10.006 -31.127 -6.802 1.00 42.14 N ATOM 880 CA SER A 55 -8.967 -31.509 -7.751 1.00 65.12 C ATOM 881 C SER A 55 -7.579 -31.280 -7.159 1.00 13.01 C ATOM 882 O SER A 55 -6.622 -31.976 -7.501 1.00 54.02 O ATOM 883 CB SER A 55 -9.116 -30.716 -9.051 1.00 10.12 C ATOM 884 OG SER A 55 -7.857 -30.268 -9.523 1.00 31.42 O ATOM 0 H SER A 55 -10.517 -30.281 -7.054 1.00 42.14 H new ATOM 0 HA SER A 55 -9.081 -32.571 -7.967 1.00 65.12 H new ATOM 0 HB2 SER A 55 -9.591 -31.340 -9.808 1.00 10.12 H new ATOM 0 HB3 SER A 55 -9.771 -29.861 -8.886 1.00 10.12 H new ATOM 0 HG SER A 55 -7.980 -29.766 -10.355 1.00 31.42 H new ATOM 890 N LEU A 56 -7.478 -30.299 -6.268 1.00 60.45 N ATOM 891 CA LEU A 56 -6.208 -29.977 -5.627 1.00 11.30 C ATOM 892 C LEU A 56 -5.832 -31.039 -4.599 1.00 63.13 C ATOM 893 O LEU A 56 -4.716 -31.048 -4.080 1.00 4.32 O ATOM 894 CB LEU A 56 -6.288 -28.605 -4.954 1.00 32.42 C ATOM 895 CG LEU A 56 -5.891 -27.409 -5.819 1.00 53.20 C ATOM 896 CD1 LEU A 56 -7.119 -26.791 -6.471 1.00 65.33 C ATOM 897 CD2 LEU A 56 -5.149 -26.373 -4.988 1.00 5.20 C ATOM 0 H LEU A 56 -8.260 -29.714 -5.974 1.00 60.45 H new ATOM 0 HA LEU A 56 -5.436 -29.954 -6.396 1.00 11.30 H new ATOM 0 HB2 LEU A 56 -7.309 -28.453 -4.605 1.00 32.42 H new ATOM 0 HB3 LEU A 56 -5.649 -28.618 -4.071 1.00 32.42 H new ATOM 0 HG LEU A 56 -5.224 -27.760 -6.606 1.00 53.20 H new ATOM 0 HD11 LEU A 56 -6.817 -25.941 -7.083 1.00 65.33 H new ATOM 0 HD12 LEU A 56 -7.610 -27.534 -7.099 1.00 65.33 H new ATOM 0 HD13 LEU A 56 -7.811 -26.455 -5.699 1.00 65.33 H new ATOM 0 HD21 LEU A 56 -4.874 -25.529 -5.620 1.00 5.20 H new ATOM 0 HD22 LEU A 56 -5.792 -26.027 -4.179 1.00 5.20 H new ATOM 0 HD23 LEU A 56 -4.248 -26.821 -4.568 1.00 5.20 H new ATOM 909 N VAL A 57 -6.770 -31.936 -4.312 1.00 10.34 N ATOM 910 CA VAL A 57 -6.536 -33.005 -3.349 1.00 31.13 C ATOM 911 C VAL A 57 -6.792 -34.372 -3.973 1.00 33.33 C ATOM 912 O VAL A 57 -5.856 -35.104 -4.295 1.00 32.14 O ATOM 913 CB VAL A 57 -7.430 -32.845 -2.104 1.00 64.43 C ATOM 914 CG1 VAL A 57 -6.619 -32.324 -0.928 1.00 23.33 C ATOM 915 CG2 VAL A 57 -8.601 -31.923 -2.405 1.00 52.12 C ATOM 0 H VAL A 57 -7.699 -31.943 -4.733 1.00 10.34 H new ATOM 0 HA VAL A 57 -5.491 -32.936 -3.047 1.00 31.13 H new ATOM 0 HB VAL A 57 -7.828 -33.824 -1.835 1.00 64.43 H new ATOM 0 HG11 VAL A 57 -7.267 -32.217 -0.058 1.00 23.33 H new ATOM 0 HG12 VAL A 57 -5.817 -33.026 -0.699 1.00 23.33 H new ATOM 0 HG13 VAL A 57 -6.191 -31.354 -1.182 1.00 23.33 H new ATOM 0 HG21 VAL A 57 -9.222 -31.821 -1.515 1.00 52.12 H new ATOM 0 HG22 VAL A 57 -8.226 -30.943 -2.700 1.00 52.12 H new ATOM 0 HG23 VAL A 57 -9.196 -32.343 -3.216 1.00 52.12 H new ATOM 925 N TRP A 58 -8.066 -34.710 -4.141 1.00 65.11 N ATOM 926 CA TRP A 58 -8.445 -35.990 -4.728 1.00 33.33 C ATOM 927 C TRP A 58 -8.553 -35.883 -6.245 1.00 30.42 C ATOM 928 O TRP A 58 -7.680 -36.355 -6.973 1.00 14.44 O ATOM 929 CB TRP A 58 -9.775 -36.469 -4.142 1.00 41.40 C ATOM 930 CG TRP A 58 -9.649 -37.019 -2.754 1.00 3.35 C ATOM 931 CD1 TRP A 58 -9.886 -36.354 -1.584 1.00 64.21 C ATOM 932 CD2 TRP A 58 -9.254 -38.346 -2.390 1.00 44.03 C ATOM 933 NE1 TRP A 58 -9.661 -37.189 -0.516 1.00 15.33 N ATOM 934 CE2 TRP A 58 -9.274 -38.416 -0.984 1.00 23.35 C ATOM 935 CE3 TRP A 58 -8.887 -39.482 -3.116 1.00 61.41 C ATOM 936 CZ2 TRP A 58 -8.940 -39.578 -0.292 1.00 1.53 C ATOM 937 CZ3 TRP A 58 -8.556 -40.634 -2.428 1.00 65.01 C ATOM 938 CH2 TRP A 58 -8.585 -40.675 -1.028 1.00 25.13 C ATOM 0 H TRP A 58 -8.853 -34.116 -3.879 1.00 65.11 H new ATOM 0 HA TRP A 58 -7.668 -36.716 -4.488 1.00 33.33 H new ATOM 0 HB2 TRP A 58 -10.480 -35.638 -4.133 1.00 41.40 H new ATOM 0 HB3 TRP A 58 -10.195 -37.236 -4.792 1.00 41.40 H new ATOM 0 HD1 TRP A 58 -10.203 -35.324 -1.510 1.00 64.21 H new ATOM 0 HE1 TRP A 58 -9.765 -36.936 0.466 1.00 15.33 H new ATOM 0 HE3 TRP A 58 -8.862 -39.460 -4.196 1.00 61.41 H new ATOM 0 HZ2 TRP A 58 -8.961 -39.612 0.787 1.00 1.53 H new ATOM 0 HZ3 TRP A 58 -8.270 -41.518 -2.979 1.00 65.01 H new ATOM 0 HH2 TRP A 58 -8.322 -41.591 -0.520 1.00 25.13 H new ATOM 949 N ASN A 59 -9.629 -35.261 -6.715 1.00 0.20 N ATOM 950 CA ASN A 59 -9.850 -35.093 -8.147 1.00 12.33 C ATOM 951 C ASN A 59 -11.077 -34.225 -8.409 1.00 75.34 C ATOM 952 O ASN A 59 -11.727 -33.753 -7.477 1.00 75.41 O ATOM 953 CB ASN A 59 -10.021 -36.455 -8.821 1.00 31.41 C ATOM 954 CG ASN A 59 -8.763 -36.909 -9.536 1.00 41.51 C ATOM 955 OD1 ASN A 59 -8.134 -36.135 -10.258 1.00 65.44 O ATOM 956 ND2 ASN A 59 -8.391 -38.168 -9.338 1.00 3.32 N ATOM 0 H ASN A 59 -10.361 -34.865 -6.126 1.00 0.20 H new ATOM 0 HA ASN A 59 -8.977 -34.594 -8.569 1.00 12.33 H new ATOM 0 HB2 ASN A 59 -10.297 -37.196 -8.071 1.00 31.41 H new ATOM 0 HB3 ASN A 59 -10.843 -36.403 -9.535 1.00 31.41 H new ATOM 0 HD21 ASN A 59 -7.553 -38.530 -9.793 1.00 3.32 H new ATOM 0 HD22 ASN A 59 -8.943 -38.774 -8.731 1.00 3.32 H new ATOM 963 N MET A 60 -11.388 -34.020 -9.685 1.00 74.52 N ATOM 964 CA MET A 60 -12.539 -33.211 -10.071 1.00 21.44 C ATOM 965 C MET A 60 -13.558 -34.047 -10.839 1.00 40.21 C ATOM 966 O MET A 60 -13.811 -33.803 -12.018 1.00 71.20 O ATOM 967 CB MET A 60 -12.091 -32.022 -10.922 1.00 62.11 C ATOM 968 CG MET A 60 -11.132 -32.401 -12.039 1.00 71.41 C ATOM 969 SD MET A 60 -10.628 -30.984 -13.033 1.00 2.11 S ATOM 970 CE MET A 60 -9.304 -31.703 -14.002 1.00 35.40 C ATOM 0 H MET A 60 -10.859 -34.403 -10.469 1.00 74.52 H new ATOM 0 HA MET A 60 -13.012 -32.839 -9.162 1.00 21.44 H new ATOM 0 HB2 MET A 60 -12.970 -31.544 -11.355 1.00 62.11 H new ATOM 0 HB3 MET A 60 -11.612 -31.285 -10.278 1.00 62.11 H new ATOM 0 HG2 MET A 60 -10.248 -32.871 -11.609 1.00 71.41 H new ATOM 0 HG3 MET A 60 -11.606 -33.142 -12.683 1.00 71.41 H new ATOM 0 HE1 MET A 60 -8.889 -30.947 -14.669 1.00 35.40 H new ATOM 0 HE2 MET A 60 -8.522 -32.068 -13.336 1.00 35.40 H new ATOM 0 HE3 MET A 60 -9.694 -32.532 -14.592 1.00 35.40 H new ATOM 980 N ASN A 61 -14.139 -35.032 -10.163 1.00 31.41 N ATOM 981 CA ASN A 61 -15.130 -35.904 -10.783 1.00 71.33 C ATOM 982 C ASN A 61 -16.346 -35.105 -11.244 1.00 24.25 C ATOM 983 O ASN A 61 -16.556 -33.971 -10.812 1.00 73.42 O ATOM 984 CB ASN A 61 -15.565 -36.996 -9.803 1.00 3.41 C ATOM 985 CG ASN A 61 -14.668 -38.217 -9.863 1.00 20.11 C ATOM 986 OD1 ASN A 61 -13.468 -38.133 -9.603 1.00 24.14 O ATOM 987 ND2 ASN A 61 -15.248 -39.361 -10.208 1.00 14.34 N ATOM 0 H ASN A 61 -13.941 -35.247 -9.186 1.00 31.41 H new ATOM 0 HA ASN A 61 -14.671 -36.370 -11.655 1.00 71.33 H new ATOM 0 HB2 ASN A 61 -15.560 -36.594 -8.790 1.00 3.41 H new ATOM 0 HB3 ASN A 61 -16.591 -37.291 -10.024 1.00 3.41 H new ATOM 0 HD21 ASN A 61 -14.695 -40.216 -10.266 1.00 14.34 H new ATOM 0 HD22 ASN A 61 -16.246 -39.384 -10.415 1.00 14.34 H new ATOM 994 N PHE A 62 -17.143 -35.704 -12.122 1.00 22.53 N ATOM 995 CA PHE A 62 -18.337 -35.049 -12.641 1.00 74.13 C ATOM 996 C PHE A 62 -19.281 -34.659 -11.507 1.00 63.10 C ATOM 997 O PHE A 62 -20.068 -33.722 -11.635 1.00 13.51 O ATOM 998 CB PHE A 62 -19.061 -35.968 -13.628 1.00 43.01 C ATOM 999 CG PHE A 62 -18.503 -35.908 -15.022 1.00 35.24 C ATOM 1000 CD1 PHE A 62 -18.425 -34.702 -15.699 1.00 73.24 C ATOM 1001 CD2 PHE A 62 -18.057 -37.058 -15.653 1.00 54.35 C ATOM 1002 CE1 PHE A 62 -17.914 -34.645 -16.982 1.00 42.31 C ATOM 1003 CE2 PHE A 62 -17.544 -37.006 -16.936 1.00 34.30 C ATOM 1004 CZ PHE A 62 -17.472 -35.798 -17.601 1.00 4.14 C ATOM 0 H PHE A 62 -16.983 -36.642 -12.489 1.00 22.53 H new ATOM 0 HA PHE A 62 -18.026 -34.142 -13.160 1.00 74.13 H new ATOM 0 HB2 PHE A 62 -19.003 -36.994 -13.266 1.00 43.01 H new ATOM 0 HB3 PHE A 62 -20.117 -35.699 -13.656 1.00 43.01 H new ATOM 0 HD1 PHE A 62 -18.767 -33.797 -15.219 1.00 73.24 H new ATOM 0 HD2 PHE A 62 -18.111 -38.005 -15.137 1.00 54.35 H new ATOM 0 HE1 PHE A 62 -17.860 -33.699 -17.500 1.00 42.31 H new ATOM 0 HE2 PHE A 62 -17.200 -37.909 -17.418 1.00 34.30 H new ATOM 0 HZ PHE A 62 -17.071 -35.755 -18.603 1.00 4.14 H new ATOM 1014 N ASP A 63 -19.195 -35.386 -10.398 1.00 41.33 N ATOM 1015 CA ASP A 63 -20.040 -35.117 -9.240 1.00 43.44 C ATOM 1016 C ASP A 63 -19.193 -34.793 -8.014 1.00 11.45 C ATOM 1017 O ASP A 63 -17.966 -34.877 -8.054 1.00 23.40 O ATOM 1018 CB ASP A 63 -20.942 -36.317 -8.950 1.00 62.25 C ATOM 1019 CG ASP A 63 -22.200 -36.313 -9.796 1.00 35.15 C ATOM 1020 OD1 ASP A 63 -22.959 -35.324 -9.725 1.00 1.33 O ATOM 1021 OD2 ASP A 63 -22.428 -37.300 -10.527 1.00 44.31 O ATOM 0 H ASP A 63 -18.549 -36.166 -10.277 1.00 41.33 H new ATOM 0 HA ASP A 63 -20.663 -34.252 -9.468 1.00 43.44 H new ATOM 0 HB2 ASP A 63 -20.387 -37.237 -9.133 1.00 62.25 H new ATOM 0 HB3 ASP A 63 -21.217 -36.315 -7.895 1.00 62.25 H new ATOM 1026 N SER A 64 -19.857 -34.420 -6.924 1.00 72.30 N ATOM 1027 CA SER A 64 -19.166 -34.079 -5.687 1.00 4.44 C ATOM 1028 C SER A 64 -18.569 -35.323 -5.036 1.00 73.21 C ATOM 1029 O SER A 64 -19.260 -36.322 -4.831 1.00 40.52 O ATOM 1030 CB SER A 64 -20.126 -33.391 -4.714 1.00 23.21 C ATOM 1031 OG SER A 64 -20.255 -32.012 -5.014 1.00 22.24 O ATOM 0 H SER A 64 -20.873 -34.347 -6.873 1.00 72.30 H new ATOM 0 HA SER A 64 -18.354 -33.394 -5.931 1.00 4.44 H new ATOM 0 HB2 SER A 64 -21.104 -33.870 -4.763 1.00 23.21 H new ATOM 0 HB3 SER A 64 -19.763 -33.512 -3.693 1.00 23.21 H new ATOM 0 HG SER A 64 -21.149 -31.703 -4.756 1.00 22.24 H new ATOM 1037 N ASP A 65 -17.282 -35.255 -4.714 1.00 33.51 N ATOM 1038 CA ASP A 65 -16.591 -36.376 -4.086 1.00 14.55 C ATOM 1039 C ASP A 65 -17.064 -36.568 -2.648 1.00 3.22 C ATOM 1040 O ASP A 65 -16.449 -36.063 -1.708 1.00 22.14 O ATOM 1041 CB ASP A 65 -15.079 -36.150 -4.113 1.00 0.42 C ATOM 1042 CG ASP A 65 -14.471 -36.462 -5.466 1.00 53.12 C ATOM 1043 OD1 ASP A 65 -14.102 -37.633 -5.694 1.00 42.53 O ATOM 1044 OD2 ASP A 65 -14.364 -35.535 -6.297 1.00 33.31 O ATOM 0 H ASP A 65 -16.696 -34.436 -4.877 1.00 33.51 H new ATOM 0 HA ASP A 65 -16.825 -37.279 -4.650 1.00 14.55 H new ATOM 0 HB2 ASP A 65 -14.865 -35.114 -3.852 1.00 0.42 H new ATOM 0 HB3 ASP A 65 -14.608 -36.774 -3.354 1.00 0.42 H new ATOM 1049 N THR A 66 -18.161 -37.300 -2.483 1.00 60.35 N ATOM 1050 CA THR A 66 -18.717 -37.557 -1.161 1.00 74.42 C ATOM 1051 C THR A 66 -18.674 -36.305 -0.293 1.00 51.14 C ATOM 1052 O THR A 66 -18.462 -36.383 0.916 1.00 60.32 O ATOM 1053 CB THR A 66 -17.961 -38.691 -0.444 1.00 63.41 C ATOM 1054 OG1 THR A 66 -18.614 -39.013 0.789 1.00 72.23 O ATOM 1055 CG2 THR A 66 -16.519 -38.291 -0.170 1.00 61.23 C ATOM 0 H THR A 66 -18.682 -37.726 -3.249 1.00 60.35 H new ATOM 0 HA THR A 66 -19.754 -37.858 -1.308 1.00 74.42 H new ATOM 0 HB THR A 66 -17.962 -39.566 -1.094 1.00 63.41 H new ATOM 0 HG1 THR A 66 -18.726 -38.198 1.322 1.00 72.23 H new ATOM 0 HG21 THR A 66 -16.005 -39.108 0.337 1.00 61.23 H new ATOM 0 HG22 THR A 66 -16.016 -38.075 -1.113 1.00 61.23 H new ATOM 0 HG23 THR A 66 -16.502 -37.403 0.462 1.00 61.23 H new ATOM 1063 N ASN A 67 -18.877 -35.150 -0.919 1.00 13.11 N ATOM 1064 CA ASN A 67 -18.862 -33.880 -0.203 1.00 5.44 C ATOM 1065 C ASN A 67 -17.673 -33.808 0.751 1.00 10.24 C ATOM 1066 O ASN A 67 -17.799 -33.342 1.884 1.00 74.20 O ATOM 1067 CB ASN A 67 -20.166 -33.693 0.575 1.00 41.51 C ATOM 1068 CG ASN A 67 -21.387 -34.049 -0.250 1.00 52.05 C ATOM 1069 OD1 ASN A 67 -21.674 -35.224 -0.479 1.00 33.10 O ATOM 1070 ND2 ASN A 67 -22.113 -33.033 -0.702 1.00 42.24 N ATOM 0 H ASN A 67 -19.054 -35.068 -1.920 1.00 13.11 H new ATOM 0 HA ASN A 67 -18.767 -33.079 -0.936 1.00 5.44 H new ATOM 0 HB2 ASN A 67 -20.143 -34.313 1.471 1.00 41.51 H new ATOM 0 HB3 ASN A 67 -20.243 -32.657 0.905 1.00 41.51 H new ATOM 0 HD21 ASN A 67 -22.946 -33.211 -1.263 1.00 42.24 H new ATOM 0 HD22 ASN A 67 -21.838 -32.074 -0.488 1.00 42.24 H new ATOM 1077 N VAL A 68 -16.518 -34.272 0.285 1.00 1.20 N ATOM 1078 CA VAL A 68 -15.306 -34.259 1.095 1.00 2.12 C ATOM 1079 C VAL A 68 -14.821 -32.834 1.336 1.00 44.24 C ATOM 1080 O VAL A 68 -14.194 -32.544 2.355 1.00 30.54 O ATOM 1081 CB VAL A 68 -14.177 -35.068 0.430 1.00 71.44 C ATOM 1082 CG1 VAL A 68 -13.837 -34.488 -0.935 1.00 23.33 C ATOM 1083 CG2 VAL A 68 -12.948 -35.104 1.325 1.00 42.51 C ATOM 0 H VAL A 68 -16.396 -34.662 -0.650 1.00 1.20 H new ATOM 0 HA VAL A 68 -15.559 -34.720 2.050 1.00 2.12 H new ATOM 0 HB VAL A 68 -14.523 -36.092 0.287 1.00 71.44 H new ATOM 0 HG11 VAL A 68 -13.037 -35.073 -1.390 1.00 23.33 H new ATOM 0 HG12 VAL A 68 -14.719 -34.521 -1.574 1.00 23.33 H new ATOM 0 HG13 VAL A 68 -13.511 -33.454 -0.820 1.00 23.33 H new ATOM 0 HG21 VAL A 68 -12.161 -35.680 0.839 1.00 42.51 H new ATOM 0 HG22 VAL A 68 -12.597 -34.087 1.502 1.00 42.51 H new ATOM 0 HG23 VAL A 68 -13.204 -35.571 2.276 1.00 42.51 H new ATOM 1093 N ILE A 69 -15.115 -31.947 0.391 1.00 63.35 N ATOM 1094 CA ILE A 69 -14.710 -30.551 0.501 1.00 63.44 C ATOM 1095 C ILE A 69 -15.460 -29.849 1.627 1.00 43.40 C ATOM 1096 O ILE A 69 -14.852 -29.215 2.490 1.00 53.40 O ATOM 1097 CB ILE A 69 -14.952 -29.790 -0.816 1.00 2.42 C ATOM 1098 CG1 ILE A 69 -14.201 -30.463 -1.966 1.00 61.51 C ATOM 1099 CG2 ILE A 69 -14.522 -28.337 -0.674 1.00 64.21 C ATOM 1100 CD1 ILE A 69 -12.713 -30.587 -1.726 1.00 5.31 C ATOM 0 H ILE A 69 -15.632 -32.170 -0.459 1.00 63.35 H new ATOM 0 HA ILE A 69 -13.643 -30.548 0.722 1.00 63.44 H new ATOM 0 HB ILE A 69 -16.018 -29.814 -1.041 1.00 2.42 H new ATOM 0 HG12 ILE A 69 -14.618 -31.457 -2.129 1.00 61.51 H new ATOM 0 HG13 ILE A 69 -14.367 -29.893 -2.880 1.00 61.51 H new ATOM 0 HG21 ILE A 69 -14.699 -27.812 -1.613 1.00 64.21 H new ATOM 0 HG22 ILE A 69 -15.098 -27.863 0.121 1.00 64.21 H new ATOM 0 HG23 ILE A 69 -13.461 -28.294 -0.429 1.00 64.21 H new ATOM 0 HD11 ILE A 69 -12.246 -31.073 -2.582 1.00 5.31 H new ATOM 0 HD12 ILE A 69 -12.282 -29.595 -1.592 1.00 5.31 H new ATOM 0 HD13 ILE A 69 -12.537 -31.182 -0.830 1.00 5.31 H new ATOM 1112 N ASP A 70 -16.783 -29.967 1.613 1.00 3.12 N ATOM 1113 CA ASP A 70 -17.617 -29.345 2.635 1.00 23.44 C ATOM 1114 C ASP A 70 -17.323 -29.938 4.010 1.00 14.02 C ATOM 1115 O ASP A 70 -17.357 -29.236 5.021 1.00 51.54 O ATOM 1116 CB ASP A 70 -19.097 -29.524 2.294 1.00 21.24 C ATOM 1117 CG ASP A 70 -20.009 -29.041 3.405 1.00 72.32 C ATOM 1118 OD1 ASP A 70 -20.202 -27.813 3.522 1.00 25.21 O ATOM 1119 OD2 ASP A 70 -20.530 -29.892 4.157 1.00 13.50 O ATOM 0 H ASP A 70 -17.301 -30.488 0.905 1.00 3.12 H new ATOM 0 HA ASP A 70 -17.385 -28.280 2.661 1.00 23.44 H new ATOM 0 HB2 ASP A 70 -19.324 -28.979 1.378 1.00 21.24 H new ATOM 0 HB3 ASP A 70 -19.297 -30.577 2.096 1.00 21.24 H new ATOM 1124 N VAL A 71 -17.037 -31.236 4.041 1.00 43.42 N ATOM 1125 CA VAL A 71 -16.738 -31.923 5.291 1.00 24.13 C ATOM 1126 C VAL A 71 -15.339 -31.575 5.789 1.00 14.32 C ATOM 1127 O VAL A 71 -15.080 -31.575 6.992 1.00 0.51 O ATOM 1128 CB VAL A 71 -16.848 -33.451 5.132 1.00 61.21 C ATOM 1129 CG1 VAL A 71 -16.461 -34.152 6.425 1.00 21.31 C ATOM 1130 CG2 VAL A 71 -18.255 -33.842 4.704 1.00 4.34 C ATOM 0 H VAL A 71 -17.006 -31.833 3.214 1.00 43.42 H new ATOM 0 HA VAL A 71 -17.475 -31.587 6.021 1.00 24.13 H new ATOM 0 HB VAL A 71 -16.154 -33.769 4.353 1.00 61.21 H new ATOM 0 HG11 VAL A 71 -16.545 -35.231 6.293 1.00 21.31 H new ATOM 0 HG12 VAL A 71 -15.433 -33.897 6.684 1.00 21.31 H new ATOM 0 HG13 VAL A 71 -17.127 -33.831 7.226 1.00 21.31 H new ATOM 0 HG21 VAL A 71 -18.315 -34.925 4.596 1.00 4.34 H new ATOM 0 HG22 VAL A 71 -18.970 -33.512 5.458 1.00 4.34 H new ATOM 0 HG23 VAL A 71 -18.490 -33.369 3.750 1.00 4.34 H new ATOM 1140 N ALA A 72 -14.442 -31.278 4.855 1.00 3.43 N ATOM 1141 CA ALA A 72 -13.070 -30.925 5.199 1.00 0.51 C ATOM 1142 C ALA A 72 -13.006 -29.553 5.863 1.00 30.32 C ATOM 1143 O ALA A 72 -12.234 -29.341 6.799 1.00 52.35 O ATOM 1144 CB ALA A 72 -12.191 -30.953 3.958 1.00 64.42 C ATOM 0 H ALA A 72 -14.640 -31.275 3.854 1.00 3.43 H new ATOM 0 HA ALA A 72 -12.699 -31.662 5.911 1.00 0.51 H new ATOM 0 HB1 ALA A 72 -11.169 -30.687 4.230 1.00 64.42 H new ATOM 0 HB2 ALA A 72 -12.203 -31.954 3.526 1.00 64.42 H new ATOM 0 HB3 ALA A 72 -12.570 -30.238 3.228 1.00 64.42 H new ATOM 1150 N VAL A 73 -13.822 -28.625 5.373 1.00 3.04 N ATOM 1151 CA VAL A 73 -13.858 -27.274 5.920 1.00 41.21 C ATOM 1152 C VAL A 73 -14.628 -27.233 7.235 1.00 20.30 C ATOM 1153 O VAL A 73 -14.287 -26.475 8.143 1.00 63.01 O ATOM 1154 CB VAL A 73 -14.502 -26.285 4.930 1.00 60.00 C ATOM 1155 CG1 VAL A 73 -15.916 -26.723 4.581 1.00 31.41 C ATOM 1156 CG2 VAL A 73 -14.498 -24.877 5.506 1.00 51.15 C ATOM 0 H VAL A 73 -14.467 -28.784 4.599 1.00 3.04 H new ATOM 0 HA VAL A 73 -12.824 -26.978 6.099 1.00 41.21 H new ATOM 0 HB VAL A 73 -13.913 -26.280 4.013 1.00 60.00 H new ATOM 0 HG11 VAL A 73 -16.355 -26.012 3.881 1.00 31.41 H new ATOM 0 HG12 VAL A 73 -15.888 -27.712 4.124 1.00 31.41 H new ATOM 0 HG13 VAL A 73 -16.520 -26.759 5.488 1.00 31.41 H new ATOM 0 HG21 VAL A 73 -14.957 -24.191 4.794 1.00 51.15 H new ATOM 0 HG22 VAL A 73 -15.063 -24.864 6.438 1.00 51.15 H new ATOM 0 HG23 VAL A 73 -13.471 -24.566 5.700 1.00 51.15 H new ATOM 1166 N ARG A 74 -15.668 -28.055 7.331 1.00 53.23 N ATOM 1167 CA ARG A 74 -16.488 -28.113 8.535 1.00 1.40 C ATOM 1168 C ARG A 74 -15.761 -28.856 9.652 1.00 73.21 C ATOM 1169 O ARG A 74 -15.833 -28.469 10.818 1.00 13.42 O ATOM 1170 CB ARG A 74 -17.823 -28.797 8.237 1.00 71.14 C ATOM 1171 CG ARG A 74 -18.770 -27.948 7.404 1.00 62.43 C ATOM 1172 CD ARG A 74 -19.508 -26.933 8.261 1.00 14.14 C ATOM 1173 NE ARG A 74 -20.484 -27.568 9.143 1.00 15.30 N ATOM 1174 CZ ARG A 74 -21.095 -26.936 10.139 1.00 13.01 C ATOM 1175 NH1 ARG A 74 -20.832 -25.659 10.379 1.00 54.33 N ATOM 1176 NH2 ARG A 74 -21.972 -27.582 10.898 1.00 43.12 N ATOM 0 H ARG A 74 -15.963 -28.690 6.589 1.00 53.23 H new ATOM 0 HA ARG A 74 -16.678 -27.092 8.865 1.00 1.40 H new ATOM 0 HB2 ARG A 74 -17.633 -29.734 7.713 1.00 71.14 H new ATOM 0 HB3 ARG A 74 -18.309 -29.051 9.179 1.00 71.14 H new ATOM 0 HG2 ARG A 74 -18.208 -27.430 6.627 1.00 62.43 H new ATOM 0 HG3 ARG A 74 -19.490 -28.592 6.900 1.00 62.43 H new ATOM 0 HD2 ARG A 74 -18.789 -26.373 8.859 1.00 14.14 H new ATOM 0 HD3 ARG A 74 -20.015 -26.215 7.617 1.00 14.14 H new ATOM 0 HE ARG A 74 -20.709 -28.550 8.986 1.00 15.30 H new ATOM 0 HH11 ARG A 74 -20.159 -25.159 9.798 1.00 54.33 H new ATOM 0 HH12 ARG A 74 -21.303 -25.176 11.144 1.00 54.33 H new ATOM 0 HH21 ARG A 74 -22.177 -28.565 10.717 1.00 43.12 H new ATOM 0 HH22 ARG A 74 -22.441 -27.096 11.662 1.00 43.12 H new ATOM 1190 N ARG A 75 -15.063 -29.926 9.287 1.00 63.05 N ATOM 1191 CA ARG A 75 -14.325 -30.725 10.258 1.00 44.25 C ATOM 1192 C ARG A 75 -13.134 -29.946 10.810 1.00 53.03 C ATOM 1193 O ARG A 75 -12.839 -30.007 12.004 1.00 64.11 O ATOM 1194 CB ARG A 75 -13.842 -32.028 9.617 1.00 55.41 C ATOM 1195 CG ARG A 75 -12.703 -31.836 8.630 1.00 41.44 C ATOM 1196 CD ARG A 75 -12.304 -33.150 7.977 1.00 50.11 C ATOM 1197 NE ARG A 75 -11.858 -34.135 8.958 1.00 22.22 N ATOM 1198 CZ ARG A 75 -11.784 -35.438 8.710 1.00 34.13 C ATOM 1199 NH1 ARG A 75 -12.125 -35.910 7.519 1.00 14.10 N ATOM 1200 NH2 ARG A 75 -11.369 -36.272 9.655 1.00 65.01 N ATOM 0 H ARG A 75 -14.993 -30.260 8.326 1.00 63.05 H new ATOM 0 HA ARG A 75 -14.997 -30.961 11.083 1.00 44.25 H new ATOM 0 HB2 ARG A 75 -13.519 -32.711 10.402 1.00 55.41 H new ATOM 0 HB3 ARG A 75 -14.679 -32.503 9.105 1.00 55.41 H new ATOM 0 HG2 ARG A 75 -13.002 -31.123 7.862 1.00 41.44 H new ATOM 0 HG3 ARG A 75 -11.843 -31.408 9.144 1.00 41.44 H new ATOM 0 HD2 ARG A 75 -13.152 -33.550 7.421 1.00 50.11 H new ATOM 0 HD3 ARG A 75 -11.506 -32.969 7.256 1.00 50.11 H new ATOM 0 HE ARG A 75 -11.588 -33.805 9.885 1.00 22.22 H new ATOM 0 HH11 ARG A 75 -12.445 -35.272 6.790 1.00 14.10 H new ATOM 0 HH12 ARG A 75 -12.067 -36.911 7.331 1.00 14.10 H new ATOM 0 HH21 ARG A 75 -11.106 -35.913 10.573 1.00 65.01 H new ATOM 0 HH22 ARG A 75 -11.313 -37.272 9.464 1.00 65.01 H new ATOM 1214 N LEU A 76 -12.454 -29.215 9.933 1.00 14.03 N ATOM 1215 CA LEU A 76 -11.295 -28.424 10.332 1.00 34.04 C ATOM 1216 C LEU A 76 -11.722 -27.198 11.134 1.00 74.34 C ATOM 1217 O LEU A 76 -11.022 -26.769 12.051 1.00 72.32 O ATOM 1218 CB LEU A 76 -10.500 -27.990 9.100 1.00 75.04 C ATOM 1219 CG LEU A 76 -10.876 -26.633 8.503 1.00 64.35 C ATOM 1220 CD1 LEU A 76 -10.184 -25.508 9.257 1.00 33.43 C ATOM 1221 CD2 LEU A 76 -10.519 -26.584 7.024 1.00 24.20 C ATOM 0 H LEU A 76 -12.685 -29.154 8.941 1.00 14.03 H new ATOM 0 HA LEU A 76 -10.662 -29.046 10.964 1.00 34.04 H new ATOM 0 HB2 LEU A 76 -9.443 -27.968 9.364 1.00 75.04 H new ATOM 0 HB3 LEU A 76 -10.620 -28.750 8.328 1.00 75.04 H new ATOM 0 HG LEU A 76 -11.953 -26.500 8.601 1.00 64.35 H new ATOM 0 HD11 LEU A 76 -10.463 -24.550 8.818 1.00 33.43 H new ATOM 0 HD12 LEU A 76 -10.488 -25.530 10.303 1.00 33.43 H new ATOM 0 HD13 LEU A 76 -9.104 -25.636 9.191 1.00 33.43 H new ATOM 0 HD21 LEU A 76 -10.793 -25.611 6.615 1.00 24.20 H new ATOM 0 HD22 LEU A 76 -9.447 -26.739 6.903 1.00 24.20 H new ATOM 0 HD23 LEU A 76 -11.061 -27.367 6.493 1.00 24.20 H new ATOM 1233 N ARG A 77 -12.876 -26.641 10.782 1.00 14.42 N ATOM 1234 CA ARG A 77 -13.397 -25.465 11.469 1.00 13.03 C ATOM 1235 C ARG A 77 -13.703 -25.780 12.931 1.00 63.13 C ATOM 1236 O ARG A 77 -13.339 -25.021 13.829 1.00 51.01 O ATOM 1237 CB ARG A 77 -14.660 -24.958 10.771 1.00 15.11 C ATOM 1238 CG ARG A 77 -15.163 -23.629 11.311 1.00 44.45 C ATOM 1239 CD ARG A 77 -16.115 -23.826 12.479 1.00 12.23 C ATOM 1240 NE ARG A 77 -16.880 -22.617 12.772 1.00 54.32 N ATOM 1241 CZ ARG A 77 -17.571 -22.437 13.892 1.00 30.12 C ATOM 1242 NH1 ARG A 77 -17.592 -23.383 14.821 1.00 62.11 N ATOM 1243 NH2 ARG A 77 -18.242 -21.309 14.086 1.00 53.04 N ATOM 0 H ARG A 77 -13.468 -26.985 10.026 1.00 14.42 H new ATOM 0 HA ARG A 77 -12.634 -24.688 11.434 1.00 13.03 H new ATOM 0 HB2 ARG A 77 -14.459 -24.854 9.705 1.00 15.11 H new ATOM 0 HB3 ARG A 77 -15.447 -25.704 10.876 1.00 15.11 H new ATOM 0 HG2 ARG A 77 -14.316 -23.021 11.629 1.00 44.45 H new ATOM 0 HG3 ARG A 77 -15.669 -23.080 10.517 1.00 44.45 H new ATOM 0 HD2 ARG A 77 -16.801 -24.643 12.254 1.00 12.23 H new ATOM 0 HD3 ARG A 77 -15.549 -24.120 13.363 1.00 12.23 H new ATOM 0 HE ARG A 77 -16.884 -21.869 12.078 1.00 54.32 H new ATOM 0 HH11 ARG A 77 -17.077 -24.251 14.676 1.00 62.11 H new ATOM 0 HH12 ARG A 77 -18.123 -23.242 15.680 1.00 62.11 H new ATOM 0 HH21 ARG A 77 -18.228 -20.578 13.374 1.00 53.04 H new ATOM 0 HH22 ARG A 77 -18.772 -21.173 14.947 1.00 53.04 H new ATOM 1257 N SER A 78 -14.373 -26.905 13.161 1.00 51.44 N ATOM 1258 CA SER A 78 -14.731 -27.318 14.512 1.00 34.23 C ATOM 1259 C SER A 78 -13.550 -27.991 15.206 1.00 54.34 C ATOM 1260 O SER A 78 -13.662 -28.452 16.342 1.00 52.32 O ATOM 1261 CB SER A 78 -15.927 -28.272 14.476 1.00 20.05 C ATOM 1262 OG SER A 78 -16.207 -28.787 15.767 1.00 71.35 O ATOM 0 H SER A 78 -14.679 -27.546 12.429 1.00 51.44 H new ATOM 0 HA SER A 78 -15.002 -26.427 15.078 1.00 34.23 H new ATOM 0 HB2 SER A 78 -16.803 -27.748 14.092 1.00 20.05 H new ATOM 0 HB3 SER A 78 -15.721 -29.094 13.790 1.00 20.05 H new ATOM 0 HG SER A 78 -15.454 -28.598 16.365 1.00 71.35 H new ATOM 1268 N LYS A 79 -12.418 -28.043 14.513 1.00 24.11 N ATOM 1269 CA LYS A 79 -11.214 -28.657 15.060 1.00 63.50 C ATOM 1270 C LYS A 79 -10.398 -27.643 15.855 1.00 13.13 C ATOM 1271 O LYS A 79 -9.796 -27.979 16.875 1.00 35.55 O ATOM 1272 CB LYS A 79 -10.359 -29.244 13.934 1.00 32.31 C ATOM 1273 CG LYS A 79 -10.369 -30.763 13.891 1.00 2.45 C ATOM 1274 CD LYS A 79 -9.590 -31.358 15.052 1.00 4.12 C ATOM 1275 CE LYS A 79 -10.123 -32.730 15.436 1.00 44.21 C ATOM 1276 NZ LYS A 79 -9.110 -33.530 16.179 1.00 71.44 N ATOM 0 H LYS A 79 -12.309 -27.667 13.571 1.00 24.11 H new ATOM 0 HA LYS A 79 -11.520 -29.459 15.733 1.00 63.50 H new ATOM 0 HB2 LYS A 79 -10.717 -28.859 12.979 1.00 32.31 H new ATOM 0 HB3 LYS A 79 -9.332 -28.899 14.052 1.00 32.31 H new ATOM 0 HG2 LYS A 79 -11.398 -31.122 13.920 1.00 2.45 H new ATOM 0 HG3 LYS A 79 -9.938 -31.104 12.950 1.00 2.45 H new ATOM 0 HD2 LYS A 79 -8.537 -31.438 14.782 1.00 4.12 H new ATOM 0 HD3 LYS A 79 -9.649 -30.690 15.911 1.00 4.12 H new ATOM 0 HE2 LYS A 79 -11.016 -32.614 16.050 1.00 44.21 H new ATOM 0 HE3 LYS A 79 -10.422 -33.268 14.537 1.00 44.21 H new ATOM 0 HZ1 LYS A 79 -9.511 -34.458 16.423 1.00 71.44 H new ATOM 0 HZ2 LYS A 79 -8.268 -33.663 15.584 1.00 71.44 H new ATOM 0 HZ3 LYS A 79 -8.843 -33.029 17.050 1.00 71.44 H new ATOM 1290 N ILE A 80 -10.384 -26.401 15.383 1.00 73.12 N ATOM 1291 CA ILE A 80 -9.645 -25.338 16.052 1.00 61.00 C ATOM 1292 C ILE A 80 -10.424 -24.027 16.028 1.00 62.35 C ATOM 1293 O ILE A 80 -10.454 -23.293 17.015 1.00 35.02 O ATOM 1294 CB ILE A 80 -8.267 -25.115 15.402 1.00 63.43 C ATOM 1295 CG1 ILE A 80 -7.632 -23.827 15.929 1.00 21.01 C ATOM 1296 CG2 ILE A 80 -8.397 -25.066 13.887 1.00 75.32 C ATOM 1297 CD1 ILE A 80 -7.870 -22.628 15.039 1.00 53.42 C ATOM 0 H ILE A 80 -10.876 -26.106 14.540 1.00 73.12 H new ATOM 0 HA ILE A 80 -9.503 -25.655 17.085 1.00 61.00 H new ATOM 0 HB ILE A 80 -7.619 -25.951 15.665 1.00 63.43 H new ATOM 0 HG12 ILE A 80 -8.028 -23.616 16.922 1.00 21.01 H new ATOM 0 HG13 ILE A 80 -6.558 -23.980 16.040 1.00 21.01 H new ATOM 0 HG21 ILE A 80 -7.414 -24.908 13.442 1.00 75.32 H new ATOM 0 HG22 ILE A 80 -8.811 -26.008 13.527 1.00 75.32 H new ATOM 0 HG23 ILE A 80 -9.059 -24.247 13.605 1.00 75.32 H new ATOM 0 HD11 ILE A 80 -7.392 -21.751 15.475 1.00 53.42 H new ATOM 0 HD12 ILE A 80 -7.449 -22.818 14.052 1.00 53.42 H new ATOM 0 HD13 ILE A 80 -8.941 -22.449 14.948 1.00 53.42 H new ATOM 1309 N ASP A 81 -11.053 -23.741 14.893 1.00 13.24 N ATOM 1310 CA ASP A 81 -11.836 -22.520 14.741 1.00 44.45 C ATOM 1311 C ASP A 81 -13.019 -22.508 15.703 1.00 72.31 C ATOM 1312 O ASP A 81 -13.593 -21.456 15.985 1.00 60.14 O ATOM 1313 CB ASP A 81 -12.332 -22.384 13.300 1.00 12.53 C ATOM 1314 CG ASP A 81 -11.886 -21.087 12.654 1.00 44.10 C ATOM 1315 OD1 ASP A 81 -10.684 -20.966 12.334 1.00 74.23 O ATOM 1316 OD2 ASP A 81 -12.737 -20.193 12.468 1.00 74.34 O ATOM 0 H ASP A 81 -11.036 -24.337 14.066 1.00 13.24 H new ATOM 0 HA ASP A 81 -11.192 -21.673 14.977 1.00 44.45 H new ATOM 0 HB2 ASP A 81 -11.965 -23.225 12.712 1.00 12.53 H new ATOM 0 HB3 ASP A 81 -13.421 -22.437 13.287 1.00 12.53 H new ATOM 1321 N ASP A 82 -13.379 -23.685 16.203 1.00 35.11 N ATOM 1322 CA ASP A 82 -14.495 -23.811 17.134 1.00 21.00 C ATOM 1323 C ASP A 82 -14.374 -22.797 18.268 1.00 63.35 C ATOM 1324 O ASP A 82 -15.367 -22.209 18.696 1.00 24.02 O ATOM 1325 CB ASP A 82 -14.553 -25.229 17.705 1.00 3.31 C ATOM 1326 CG ASP A 82 -13.488 -25.474 18.756 1.00 43.51 C ATOM 1327 OD1 ASP A 82 -12.315 -25.677 18.377 1.00 51.03 O ATOM 1328 OD2 ASP A 82 -13.827 -25.461 19.958 1.00 45.24 O ATOM 0 H ASP A 82 -12.915 -24.565 15.980 1.00 35.11 H new ATOM 0 HA ASP A 82 -15.416 -23.610 16.588 1.00 21.00 H new ATOM 0 HB2 ASP A 82 -15.537 -25.402 18.142 1.00 3.31 H new ATOM 0 HB3 ASP A 82 -14.433 -25.949 16.895 1.00 3.31 H new ATOM 1333 N ASP A 83 -13.152 -22.599 18.749 1.00 64.21 N ATOM 1334 CA ASP A 83 -12.900 -21.657 19.833 1.00 53.41 C ATOM 1335 C ASP A 83 -11.713 -20.756 19.506 1.00 71.12 C ATOM 1336 O ASP A 83 -10.902 -20.440 20.376 1.00 21.13 O ATOM 1337 CB ASP A 83 -12.642 -22.407 21.140 1.00 20.13 C ATOM 1338 CG ASP A 83 -12.956 -21.567 22.362 1.00 13.52 C ATOM 1339 OD1 ASP A 83 -13.836 -20.686 22.266 1.00 51.14 O ATOM 1340 OD2 ASP A 83 -12.322 -21.789 23.415 1.00 41.20 O ATOM 0 H ASP A 83 -12.320 -23.078 18.405 1.00 64.21 H new ATOM 0 HA ASP A 83 -13.785 -21.032 19.951 1.00 53.41 H new ATOM 0 HB2 ASP A 83 -13.247 -23.313 21.161 1.00 20.13 H new ATOM 0 HB3 ASP A 83 -11.598 -22.720 21.176 1.00 20.13 H new ATOM 1345 N PHE A 84 -11.617 -20.347 18.245 1.00 30.01 N ATOM 1346 CA PHE A 84 -10.528 -19.485 17.802 1.00 2.41 C ATOM 1347 C PHE A 84 -11.050 -18.368 16.903 1.00 44.13 C ATOM 1348 O PHE A 84 -10.619 -17.220 17.008 1.00 23.21 O ATOM 1349 CB PHE A 84 -9.471 -20.303 17.057 1.00 34.31 C ATOM 1350 CG PHE A 84 -8.425 -20.894 17.958 1.00 0.44 C ATOM 1351 CD1 PHE A 84 -8.757 -21.877 18.876 1.00 70.41 C ATOM 1352 CD2 PHE A 84 -7.109 -20.465 17.888 1.00 72.31 C ATOM 1353 CE1 PHE A 84 -7.796 -22.422 19.707 1.00 51.41 C ATOM 1354 CE2 PHE A 84 -6.144 -21.006 18.716 1.00 22.21 C ATOM 1355 CZ PHE A 84 -6.488 -21.986 19.626 1.00 23.41 C ATOM 0 H PHE A 84 -12.280 -20.599 17.512 1.00 30.01 H new ATOM 0 HA PHE A 84 -10.073 -19.035 18.684 1.00 2.41 H new ATOM 0 HB2 PHE A 84 -9.964 -21.107 16.510 1.00 34.31 H new ATOM 0 HB3 PHE A 84 -8.985 -19.666 16.318 1.00 34.31 H new ATOM 0 HD1 PHE A 84 -9.778 -22.222 18.943 1.00 70.41 H new ATOM 0 HD2 PHE A 84 -6.834 -19.699 17.178 1.00 72.31 H new ATOM 0 HE1 PHE A 84 -8.068 -23.188 20.419 1.00 51.41 H new ATOM 0 HE2 PHE A 84 -5.122 -20.663 18.651 1.00 22.21 H new ATOM 0 HZ PHE A 84 -5.735 -22.411 20.273 1.00 23.41 H new ATOM 1365 N GLU A 85 -11.980 -18.714 16.018 1.00 23.32 N ATOM 1366 CA GLU A 85 -12.559 -17.742 15.099 1.00 11.44 C ATOM 1367 C GLU A 85 -14.019 -18.074 14.805 1.00 60.14 C ATOM 1368 O GLU A 85 -14.476 -19.201 14.996 1.00 71.21 O ATOM 1369 CB GLU A 85 -11.761 -17.700 13.795 1.00 65.41 C ATOM 1370 CG GLU A 85 -10.571 -16.756 13.839 1.00 23.42 C ATOM 1371 CD GLU A 85 -10.984 -15.303 13.969 1.00 65.10 C ATOM 1372 OE1 GLU A 85 -11.257 -14.864 15.106 1.00 71.03 O ATOM 1373 OE2 GLU A 85 -11.033 -14.605 12.935 1.00 73.22 O ATOM 0 H GLU A 85 -12.348 -19.660 15.918 1.00 23.32 H new ATOM 0 HA GLU A 85 -12.516 -16.762 15.574 1.00 11.44 H new ATOM 0 HB2 GLU A 85 -11.408 -18.705 13.562 1.00 65.41 H new ATOM 0 HB3 GLU A 85 -12.423 -17.399 12.983 1.00 65.41 H new ATOM 0 HG2 GLU A 85 -9.930 -17.024 14.679 1.00 23.42 H new ATOM 0 HG3 GLU A 85 -9.978 -16.882 12.933 1.00 23.42 H new ATOM 1380 N PRO A 86 -14.769 -17.070 14.328 1.00 55.13 N ATOM 1381 CA PRO A 86 -16.188 -17.230 13.996 1.00 33.42 C ATOM 1382 C PRO A 86 -16.401 -18.104 12.765 1.00 63.13 C ATOM 1383 O PRO A 86 -15.463 -18.722 12.260 1.00 72.50 O ATOM 1384 CB PRO A 86 -16.653 -15.798 13.722 1.00 42.20 C ATOM 1385 CG PRO A 86 -15.420 -15.073 13.305 1.00 23.13 C ATOM 1386 CD PRO A 86 -14.291 -15.701 14.075 1.00 5.50 C ATOM 0 HA PRO A 86 -16.739 -17.726 14.795 1.00 33.42 H new ATOM 0 HB2 PRO A 86 -17.412 -15.771 12.940 1.00 42.20 H new ATOM 0 HB3 PRO A 86 -17.095 -15.348 14.611 1.00 42.20 H new ATOM 0 HG2 PRO A 86 -15.258 -15.164 12.231 1.00 23.13 H new ATOM 0 HG3 PRO A 86 -15.499 -14.009 13.526 1.00 23.13 H new ATOM 0 HD2 PRO A 86 -13.364 -15.699 13.502 1.00 5.50 H new ATOM 0 HD3 PRO A 86 -14.093 -15.167 15.004 1.00 5.50 H new ATOM 1394 N LYS A 87 -17.639 -18.151 12.284 1.00 3.24 N ATOM 1395 CA LYS A 87 -17.975 -18.947 11.110 1.00 21.44 C ATOM 1396 C LYS A 87 -17.725 -18.159 9.828 1.00 34.35 C ATOM 1397 O LYS A 87 -18.654 -17.610 9.235 1.00 53.32 O ATOM 1398 CB LYS A 87 -19.438 -19.392 11.172 1.00 50.30 C ATOM 1399 CG LYS A 87 -20.410 -18.252 11.426 1.00 65.12 C ATOM 1400 CD LYS A 87 -21.683 -18.414 10.613 1.00 13.24 C ATOM 1401 CE LYS A 87 -22.513 -19.589 11.106 1.00 34.13 C ATOM 1402 NZ LYS A 87 -23.924 -19.508 10.636 1.00 11.44 N ATOM 0 H LYS A 87 -18.427 -17.646 12.690 1.00 3.24 H new ATOM 0 HA LYS A 87 -17.334 -19.828 11.104 1.00 21.44 H new ATOM 0 HB2 LYS A 87 -19.701 -19.880 10.233 1.00 50.30 H new ATOM 0 HB3 LYS A 87 -19.550 -20.136 11.961 1.00 50.30 H new ATOM 0 HG2 LYS A 87 -20.657 -18.213 12.487 1.00 65.12 H new ATOM 0 HG3 LYS A 87 -19.934 -17.304 11.174 1.00 65.12 H new ATOM 0 HD2 LYS A 87 -22.273 -17.500 10.673 1.00 13.24 H new ATOM 0 HD3 LYS A 87 -21.429 -18.561 9.563 1.00 13.24 H new ATOM 0 HE2 LYS A 87 -22.067 -20.520 10.757 1.00 34.13 H new ATOM 0 HE3 LYS A 87 -22.494 -19.615 12.196 1.00 34.13 H new ATOM 0 HZ1 LYS A 87 -24.456 -20.327 10.993 1.00 11.44 H new ATOM 0 HZ2 LYS A 87 -24.358 -18.632 10.990 1.00 11.44 H new ATOM 0 HZ3 LYS A 87 -23.944 -19.509 9.596 1.00 11.44 H new ATOM 1416 N LEU A 88 -16.467 -18.109 9.406 1.00 70.02 N ATOM 1417 CA LEU A 88 -16.096 -17.389 8.193 1.00 64.25 C ATOM 1418 C LEU A 88 -16.534 -18.156 6.949 1.00 54.52 C ATOM 1419 O LEU A 88 -16.496 -17.628 5.837 1.00 13.40 O ATOM 1420 CB LEU A 88 -14.584 -17.158 8.156 1.00 50.51 C ATOM 1421 CG LEU A 88 -14.035 -16.149 9.166 1.00 40.15 C ATOM 1422 CD1 LEU A 88 -13.945 -16.773 10.549 1.00 34.42 C ATOM 1423 CD2 LEU A 88 -12.673 -15.636 8.720 1.00 20.35 C ATOM 0 H LEU A 88 -15.687 -18.558 9.885 1.00 70.02 H new ATOM 0 HA LEU A 88 -16.605 -16.425 8.202 1.00 64.25 H new ATOM 0 HB2 LEU A 88 -14.086 -18.114 8.320 1.00 50.51 H new ATOM 0 HB3 LEU A 88 -14.312 -16.825 7.155 1.00 50.51 H new ATOM 0 HG LEU A 88 -14.721 -15.304 9.216 1.00 40.15 H new ATOM 0 HD11 LEU A 88 -13.552 -16.040 11.254 1.00 34.42 H new ATOM 0 HD12 LEU A 88 -14.937 -17.090 10.870 1.00 34.42 H new ATOM 0 HD13 LEU A 88 -13.281 -17.637 10.516 1.00 34.42 H new ATOM 0 HD21 LEU A 88 -12.297 -14.919 9.450 1.00 20.35 H new ATOM 0 HD22 LEU A 88 -11.978 -16.472 8.641 1.00 20.35 H new ATOM 0 HD23 LEU A 88 -12.768 -15.149 7.749 1.00 20.35 H new ATOM 1435 N ILE A 89 -16.952 -19.401 7.145 1.00 73.52 N ATOM 1436 CA ILE A 89 -17.402 -20.239 6.039 1.00 5.34 C ATOM 1437 C ILE A 89 -18.663 -19.672 5.398 1.00 53.42 C ATOM 1438 O ILE A 89 -19.734 -19.669 6.005 1.00 14.34 O ATOM 1439 CB ILE A 89 -17.678 -21.681 6.502 1.00 34.32 C ATOM 1440 CG1 ILE A 89 -16.464 -22.244 7.244 1.00 71.12 C ATOM 1441 CG2 ILE A 89 -18.033 -22.560 5.312 1.00 34.43 C ATOM 1442 CD1 ILE A 89 -16.734 -23.565 7.930 1.00 41.01 C ATOM 0 H ILE A 89 -16.989 -19.853 8.059 1.00 73.52 H new ATOM 0 HA ILE A 89 -16.598 -20.250 5.304 1.00 5.34 H new ATOM 0 HB ILE A 89 -18.525 -21.671 7.187 1.00 34.32 H new ATOM 0 HG12 ILE A 89 -15.644 -22.372 6.538 1.00 71.12 H new ATOM 0 HG13 ILE A 89 -16.134 -21.518 7.988 1.00 71.12 H new ATOM 0 HG21 ILE A 89 -18.225 -23.577 5.655 1.00 34.43 H new ATOM 0 HG22 ILE A 89 -18.924 -22.167 4.823 1.00 34.43 H new ATOM 0 HG23 ILE A 89 -17.204 -22.567 4.604 1.00 34.43 H new ATOM 0 HD11 ILE A 89 -15.830 -23.904 8.435 1.00 41.01 H new ATOM 0 HD12 ILE A 89 -17.533 -23.439 8.661 1.00 41.01 H new ATOM 0 HD13 ILE A 89 -17.034 -24.305 7.189 1.00 41.01 H new ATOM 1454 N HIS A 90 -18.530 -19.193 4.165 1.00 61.33 N ATOM 1455 CA HIS A 90 -19.660 -18.625 3.439 1.00 73.55 C ATOM 1456 C HIS A 90 -19.810 -19.280 2.068 1.00 3.52 C ATOM 1457 O HIS A 90 -18.879 -19.276 1.262 1.00 70.24 O ATOM 1458 CB HIS A 90 -19.484 -17.115 3.279 1.00 34.02 C ATOM 1459 CG HIS A 90 -20.003 -16.326 4.442 1.00 44.32 C ATOM 1460 ND1 HIS A 90 -21.143 -15.554 4.379 1.00 53.53 N ATOM 1461 CD2 HIS A 90 -19.530 -16.193 5.703 1.00 22.42 C ATOM 1462 CE1 HIS A 90 -21.349 -14.979 5.550 1.00 3.04 C ATOM 1463 NE2 HIS A 90 -20.384 -15.351 6.372 1.00 62.40 N ATOM 0 H HIS A 90 -17.651 -19.187 3.648 1.00 61.33 H new ATOM 0 HA HIS A 90 -20.565 -18.818 4.016 1.00 73.55 H new ATOM 0 HB2 HIS A 90 -18.426 -16.893 3.143 1.00 34.02 H new ATOM 0 HB3 HIS A 90 -19.997 -16.791 2.373 1.00 34.02 H new ATOM 0 HD2 HIS A 90 -18.645 -16.662 6.108 1.00 22.42 H new ATOM 0 HE1 HIS A 90 -22.167 -14.317 5.794 1.00 3.04 H new ATOM 0 HE2 HIS A 90 -20.289 -15.060 7.345 1.00 62.40 H new ATOM 1471 N THR A 91 -20.987 -19.841 1.811 1.00 62.31 N ATOM 1472 CA THR A 91 -21.257 -20.501 0.540 1.00 54.22 C ATOM 1473 C THR A 91 -22.525 -19.953 -0.105 1.00 53.41 C ATOM 1474 O THR A 91 -23.613 -20.047 0.463 1.00 54.50 O ATOM 1475 CB THR A 91 -21.402 -22.024 0.717 1.00 75.12 C ATOM 1476 OG1 THR A 91 -20.179 -22.578 1.213 1.00 30.23 O ATOM 1477 CG2 THR A 91 -21.769 -22.690 -0.601 1.00 44.42 C ATOM 0 H THR A 91 -21.769 -19.852 2.466 1.00 62.31 H new ATOM 0 HA THR A 91 -20.405 -20.298 -0.109 1.00 54.22 H new ATOM 0 HB THR A 91 -22.202 -22.210 1.434 1.00 75.12 H new ATOM 0 HG1 THR A 91 -20.280 -23.546 1.324 1.00 30.23 H new ATOM 0 HG21 THR A 91 -21.866 -23.765 -0.451 1.00 44.42 H new ATOM 0 HG22 THR A 91 -22.716 -22.287 -0.961 1.00 44.42 H new ATOM 0 HG23 THR A 91 -20.989 -22.495 -1.337 1.00 44.42 H new ATOM 1485 N VAL A 92 -22.378 -19.380 -1.296 1.00 32.22 N ATOM 1486 CA VAL A 92 -23.512 -18.818 -2.019 1.00 75.33 C ATOM 1487 C VAL A 92 -24.222 -19.886 -2.844 1.00 61.40 C ATOM 1488 O VAL A 92 -23.618 -20.520 -3.710 1.00 2.42 O ATOM 1489 CB VAL A 92 -23.072 -17.674 -2.951 1.00 55.33 C ATOM 1490 CG1 VAL A 92 -24.285 -16.967 -3.539 1.00 23.33 C ATOM 1491 CG2 VAL A 92 -22.183 -16.692 -2.205 1.00 5.53 C ATOM 0 H VAL A 92 -21.484 -19.293 -1.780 1.00 32.22 H new ATOM 0 HA VAL A 92 -24.200 -18.424 -1.271 1.00 75.33 H new ATOM 0 HB VAL A 92 -22.496 -18.099 -3.773 1.00 55.33 H new ATOM 0 HG11 VAL A 92 -23.954 -16.162 -4.195 1.00 23.33 H new ATOM 0 HG12 VAL A 92 -24.880 -17.679 -4.111 1.00 23.33 H new ATOM 0 HG13 VAL A 92 -24.891 -16.553 -2.733 1.00 23.33 H new ATOM 0 HG21 VAL A 92 -21.881 -15.890 -2.879 1.00 5.53 H new ATOM 0 HG22 VAL A 92 -22.732 -16.271 -1.363 1.00 5.53 H new ATOM 0 HG23 VAL A 92 -21.297 -17.210 -1.838 1.00 5.53 H new ATOM 1501 N ARG A 93 -25.508 -20.081 -2.570 1.00 3.14 N ATOM 1502 CA ARG A 93 -26.300 -21.073 -3.286 1.00 31.21 C ATOM 1503 C ARG A 93 -26.336 -20.765 -4.780 1.00 22.01 C ATOM 1504 O ARG A 93 -27.104 -19.917 -5.231 1.00 53.10 O ATOM 1505 CB ARG A 93 -27.724 -21.118 -2.729 1.00 73.04 C ATOM 1506 CG ARG A 93 -28.563 -22.254 -3.293 1.00 0.50 C ATOM 1507 CD ARG A 93 -29.894 -22.376 -2.568 1.00 53.54 C ATOM 1508 NE ARG A 93 -29.806 -23.255 -1.406 1.00 33.20 N ATOM 1509 CZ ARG A 93 -30.863 -23.666 -0.714 1.00 22.32 C ATOM 1510 NH1 ARG A 93 -32.081 -23.280 -1.065 1.00 53.34 N ATOM 1511 NH2 ARG A 93 -30.702 -24.466 0.332 1.00 23.54 N ATOM 0 H ARG A 93 -26.023 -19.565 -1.857 1.00 3.14 H new ATOM 0 HA ARG A 93 -25.831 -22.047 -3.145 1.00 31.21 H new ATOM 0 HB2 ARG A 93 -27.678 -21.215 -1.644 1.00 73.04 H new ATOM 0 HB3 ARG A 93 -28.219 -20.171 -2.943 1.00 73.04 H new ATOM 0 HG2 ARG A 93 -28.740 -22.085 -4.355 1.00 0.50 H new ATOM 0 HG3 ARG A 93 -28.013 -23.191 -3.207 1.00 0.50 H new ATOM 0 HD2 ARG A 93 -30.226 -21.387 -2.250 1.00 53.54 H new ATOM 0 HD3 ARG A 93 -30.648 -22.759 -3.256 1.00 53.54 H new ATOM 0 HE ARG A 93 -28.883 -23.571 -1.109 1.00 33.20 H new ATOM 0 HH11 ARG A 93 -32.209 -22.665 -1.869 1.00 53.34 H new ATOM 0 HH12 ARG A 93 -32.890 -23.598 -0.531 1.00 53.34 H new ATOM 0 HH21 ARG A 93 -29.766 -24.766 0.605 1.00 23.54 H new ATOM 0 HH22 ARG A 93 -31.514 -24.781 0.863 1.00 23.54 H new ATOM 1525 N GLY A 94 -25.497 -21.460 -5.543 1.00 35.32 N ATOM 1526 CA GLY A 94 -25.449 -21.246 -6.977 1.00 64.23 C ATOM 1527 C GLY A 94 -24.144 -20.618 -7.426 1.00 11.24 C ATOM 1528 O GLY A 94 -24.075 -20.008 -8.492 1.00 74.03 O ATOM 0 H GLY A 94 -24.850 -22.167 -5.193 1.00 35.32 H new ATOM 0 HA2 GLY A 94 -25.585 -22.199 -7.488 1.00 64.23 H new ATOM 0 HA3 GLY A 94 -26.279 -20.604 -7.273 1.00 64.23 H new ATOM 1532 N ALA A 95 -23.107 -20.765 -6.608 1.00 44.02 N ATOM 1533 CA ALA A 95 -21.798 -20.207 -6.927 1.00 30.33 C ATOM 1534 C ALA A 95 -20.688 -21.213 -6.640 1.00 11.01 C ATOM 1535 O ALA A 95 -20.037 -21.711 -7.557 1.00 24.33 O ATOM 1536 CB ALA A 95 -21.566 -18.924 -6.142 1.00 70.34 C ATOM 0 H ALA A 95 -23.148 -21.265 -5.720 1.00 44.02 H new ATOM 0 HA ALA A 95 -21.778 -19.977 -7.992 1.00 30.33 H new ATOM 0 HB1 ALA A 95 -20.585 -18.518 -6.390 1.00 70.34 H new ATOM 0 HB2 ALA A 95 -22.335 -18.196 -6.399 1.00 70.34 H new ATOM 0 HB3 ALA A 95 -21.611 -19.138 -5.074 1.00 70.34 H new ATOM 1542 N GLY A 96 -20.478 -21.506 -5.360 1.00 63.52 N ATOM 1543 CA GLY A 96 -19.445 -22.451 -4.976 1.00 1.21 C ATOM 1544 C GLY A 96 -19.092 -22.357 -3.505 1.00 31.23 C ATOM 1545 O GLY A 96 -19.751 -22.967 -2.661 1.00 45.53 O ATOM 0 H GLY A 96 -21.004 -21.106 -4.583 1.00 63.52 H new ATOM 0 HA2 GLY A 96 -19.780 -23.463 -5.202 1.00 1.21 H new ATOM 0 HA3 GLY A 96 -18.551 -22.270 -5.573 1.00 1.21 H new ATOM 1549 N TYR A 97 -18.050 -21.594 -3.195 1.00 41.04 N ATOM 1550 CA TYR A 97 -17.608 -21.426 -1.816 1.00 60.21 C ATOM 1551 C TYR A 97 -16.647 -20.248 -1.692 1.00 24.25 C ATOM 1552 O TYR A 97 -15.795 -20.033 -2.554 1.00 25.03 O ATOM 1553 CB TYR A 97 -16.933 -22.705 -1.316 1.00 14.55 C ATOM 1554 CG TYR A 97 -16.373 -22.585 0.084 1.00 63.34 C ATOM 1555 CD1 TYR A 97 -17.106 -21.984 1.099 1.00 54.24 C ATOM 1556 CD2 TYR A 97 -15.109 -23.075 0.391 1.00 72.33 C ATOM 1557 CE1 TYR A 97 -16.598 -21.872 2.378 1.00 64.20 C ATOM 1558 CE2 TYR A 97 -14.593 -22.969 1.668 1.00 60.33 C ATOM 1559 CZ TYR A 97 -15.341 -22.367 2.658 1.00 43.53 C ATOM 1560 OH TYR A 97 -14.831 -22.259 3.931 1.00 1.53 O ATOM 0 H TYR A 97 -17.495 -21.082 -3.881 1.00 41.04 H new ATOM 0 HA TYR A 97 -18.485 -21.222 -1.202 1.00 60.21 H new ATOM 0 HB2 TYR A 97 -17.655 -23.521 -1.341 1.00 14.55 H new ATOM 0 HB3 TYR A 97 -16.127 -22.972 -1.999 1.00 14.55 H new ATOM 0 HD1 TYR A 97 -18.091 -21.597 0.884 1.00 54.24 H new ATOM 0 HD2 TYR A 97 -14.520 -23.547 -0.382 1.00 72.33 H new ATOM 0 HE1 TYR A 97 -17.181 -21.400 3.155 1.00 64.20 H new ATOM 0 HE2 TYR A 97 -13.609 -23.355 1.890 1.00 60.33 H new ATOM 0 HH TYR A 97 -13.924 -22.629 3.952 1.00 1.53 H new ATOM 1570 N VAL A 98 -16.790 -19.488 -0.611 1.00 2.42 N ATOM 1571 CA VAL A 98 -15.934 -18.332 -0.370 1.00 51.13 C ATOM 1572 C VAL A 98 -15.700 -18.122 1.121 1.00 33.05 C ATOM 1573 O VAL A 98 -16.498 -18.557 1.953 1.00 1.24 O ATOM 1574 CB VAL A 98 -16.542 -17.049 -0.969 1.00 23.40 C ATOM 1575 CG1 VAL A 98 -17.768 -16.620 -0.178 1.00 41.31 C ATOM 1576 CG2 VAL A 98 -15.505 -15.937 -1.007 1.00 50.24 C ATOM 0 H VAL A 98 -17.491 -19.652 0.112 1.00 2.42 H new ATOM 0 HA VAL A 98 -14.981 -18.537 -0.859 1.00 51.13 H new ATOM 0 HB VAL A 98 -16.855 -17.258 -1.992 1.00 23.40 H new ATOM 0 HG11 VAL A 98 -18.184 -15.712 -0.615 1.00 41.31 H new ATOM 0 HG12 VAL A 98 -18.516 -17.413 -0.207 1.00 41.31 H new ATOM 0 HG13 VAL A 98 -17.484 -16.427 0.857 1.00 41.31 H new ATOM 0 HG21 VAL A 98 -15.951 -15.038 -1.433 1.00 50.24 H new ATOM 0 HG22 VAL A 98 -15.160 -15.726 0.005 1.00 50.24 H new ATOM 0 HG23 VAL A 98 -14.660 -16.248 -1.621 1.00 50.24 H new ATOM 1586 N LEU A 99 -14.602 -17.453 1.454 1.00 10.20 N ATOM 1587 CA LEU A 99 -14.262 -17.184 2.847 1.00 53.20 C ATOM 1588 C LEU A 99 -14.332 -15.690 3.146 1.00 44.44 C ATOM 1589 O LEU A 99 -13.828 -14.870 2.378 1.00 33.11 O ATOM 1590 CB LEU A 99 -12.863 -17.714 3.163 1.00 63.23 C ATOM 1591 CG LEU A 99 -11.699 -16.784 2.818 1.00 61.54 C ATOM 1592 CD1 LEU A 99 -10.393 -17.339 3.365 1.00 44.35 C ATOM 1593 CD2 LEU A 99 -11.606 -16.583 1.312 1.00 1.41 C ATOM 0 H LEU A 99 -13.931 -17.087 0.778 1.00 10.20 H new ATOM 0 HA LEU A 99 -14.989 -17.696 3.478 1.00 53.20 H new ATOM 0 HB2 LEU A 99 -12.815 -17.944 4.227 1.00 63.23 H new ATOM 0 HB3 LEU A 99 -12.723 -18.653 2.628 1.00 63.23 H new ATOM 0 HG LEU A 99 -11.882 -15.815 3.283 1.00 61.54 H new ATOM 0 HD11 LEU A 99 -9.576 -16.664 3.110 1.00 44.35 H new ATOM 0 HD12 LEU A 99 -10.463 -17.431 4.449 1.00 44.35 H new ATOM 0 HD13 LEU A 99 -10.203 -18.320 2.929 1.00 44.35 H new ATOM 0 HD21 LEU A 99 -10.772 -15.919 1.084 1.00 1.41 H new ATOM 0 HD22 LEU A 99 -11.446 -17.545 0.826 1.00 1.41 H new ATOM 0 HD23 LEU A 99 -12.533 -16.141 0.946 1.00 1.41 H new ATOM 1605 N GLU A 100 -14.957 -15.344 4.267 1.00 45.32 N ATOM 1606 CA GLU A 100 -15.090 -13.948 4.667 1.00 43.21 C ATOM 1607 C GLU A 100 -15.468 -13.838 6.141 1.00 31.11 C ATOM 1608 O GLU A 100 -15.702 -14.846 6.809 1.00 1.43 O ATOM 1609 CB GLU A 100 -16.141 -13.245 3.805 1.00 32.35 C ATOM 1610 CG GLU A 100 -15.561 -12.539 2.592 1.00 42.11 C ATOM 1611 CD GLU A 100 -16.381 -11.336 2.169 1.00 14.24 C ATOM 1612 OE1 GLU A 100 -17.492 -11.156 2.711 1.00 33.32 O ATOM 1613 OE2 GLU A 100 -15.913 -10.574 1.297 1.00 34.35 O ATOM 0 H GLU A 100 -15.379 -16.010 4.914 1.00 45.32 H new ATOM 0 HA GLU A 100 -14.126 -13.461 4.520 1.00 43.21 H new ATOM 0 HB2 GLU A 100 -16.875 -13.979 3.471 1.00 32.35 H new ATOM 0 HB3 GLU A 100 -16.674 -12.518 4.418 1.00 32.35 H new ATOM 0 HG2 GLU A 100 -14.543 -12.220 2.815 1.00 42.11 H new ATOM 0 HG3 GLU A 100 -15.500 -13.242 1.762 1.00 42.11 H new ATOM 1620 N ILE A 101 -15.526 -12.608 6.641 1.00 24.31 N ATOM 1621 CA ILE A 101 -15.876 -12.367 8.035 1.00 2.42 C ATOM 1622 C ILE A 101 -17.185 -11.593 8.147 1.00 40.31 C ATOM 1623 O ILE A 101 -17.670 -11.028 7.166 1.00 22.41 O ATOM 1624 CB ILE A 101 -14.767 -11.587 8.767 1.00 15.10 C ATOM 1625 CG1 ILE A 101 -14.516 -10.245 8.075 1.00 23.45 C ATOM 1626 CG2 ILE A 101 -13.489 -12.409 8.821 1.00 23.32 C ATOM 1627 CD1 ILE A 101 -13.571 -9.342 8.836 1.00 42.41 C ATOM 0 H ILE A 101 -15.335 -11.764 6.102 1.00 24.31 H new ATOM 0 HA ILE A 101 -15.993 -13.344 8.505 1.00 2.42 H new ATOM 0 HB ILE A 101 -15.093 -11.392 9.789 1.00 15.10 H new ATOM 0 HG12 ILE A 101 -14.109 -10.428 7.081 1.00 23.45 H new ATOM 0 HG13 ILE A 101 -15.468 -9.731 7.940 1.00 23.45 H new ATOM 0 HG21 ILE A 101 -12.715 -11.845 9.341 1.00 23.32 H new ATOM 0 HG22 ILE A 101 -13.678 -13.341 9.354 1.00 23.32 H new ATOM 0 HG23 ILE A 101 -13.156 -12.632 7.807 1.00 23.32 H new ATOM 0 HD11 ILE A 101 -13.439 -8.409 8.288 1.00 42.41 H new ATOM 0 HD12 ILE A 101 -13.986 -9.129 9.821 1.00 42.41 H new ATOM 0 HD13 ILE A 101 -12.606 -9.837 8.948 1.00 42.41 H new ATOM 1639 N ARG A 102 -17.751 -11.569 9.349 1.00 73.20 N ATOM 1640 CA ARG A 102 -19.004 -10.864 9.589 1.00 13.35 C ATOM 1641 C ARG A 102 -18.743 -9.445 10.086 1.00 3.21 C ATOM 1642 O ARG A 102 -19.570 -8.552 9.906 1.00 33.24 O ATOM 1643 CB ARG A 102 -19.855 -11.624 10.609 1.00 4.31 C ATOM 1644 CG ARG A 102 -20.621 -12.793 10.012 1.00 24.15 C ATOM 1645 CD ARG A 102 -21.698 -13.295 10.961 1.00 72.13 C ATOM 1646 NE ARG A 102 -22.919 -12.499 10.872 1.00 75.21 N ATOM 1647 CZ ARG A 102 -23.823 -12.644 9.909 1.00 62.22 C ATOM 1648 NH1 ARG A 102 -23.643 -13.550 8.958 1.00 71.42 N ATOM 1649 NH2 ARG A 102 -24.909 -11.882 9.896 1.00 30.21 N ATOM 0 H ARG A 102 -17.362 -12.030 10.172 1.00 73.20 H new ATOM 0 HA ARG A 102 -19.546 -10.807 8.645 1.00 13.35 H new ATOM 0 HB2 ARG A 102 -19.209 -11.993 11.406 1.00 4.31 H new ATOM 0 HB3 ARG A 102 -20.563 -10.933 11.067 1.00 4.31 H new ATOM 0 HG2 ARG A 102 -21.077 -12.488 9.070 1.00 24.15 H new ATOM 0 HG3 ARG A 102 -19.929 -13.604 9.783 1.00 24.15 H new ATOM 0 HD2 ARG A 102 -21.926 -14.336 10.732 1.00 72.13 H new ATOM 0 HD3 ARG A 102 -21.321 -13.268 11.984 1.00 72.13 H new ATOM 0 HE ARG A 102 -23.087 -11.793 11.589 1.00 75.21 H new ATOM 0 HH11 ARG A 102 -22.809 -14.138 8.965 1.00 71.42 H new ATOM 0 HH12 ARG A 102 -24.338 -13.660 8.220 1.00 71.42 H new ATOM 0 HH21 ARG A 102 -25.051 -11.184 10.626 1.00 30.21 H new ATOM 0 HH22 ARG A 102 -25.602 -11.994 9.156 1.00 30.21 H new ATOM 1663 N GLU A 103 -17.587 -9.246 10.712 1.00 44.14 N ATOM 1664 CA GLU A 103 -17.218 -7.936 11.235 1.00 4.10 C ATOM 1665 C GLU A 103 -17.176 -6.896 10.119 1.00 70.10 C ATOM 1666 O GLU A 103 -17.516 -5.732 10.329 1.00 75.43 O ATOM 1667 CB GLU A 103 -15.858 -8.006 11.933 1.00 3.40 C ATOM 1668 CG GLU A 103 -15.735 -9.161 12.912 1.00 25.10 C ATOM 1669 CD GLU A 103 -16.891 -9.223 13.890 1.00 15.33 C ATOM 1670 OE1 GLU A 103 -17.934 -9.815 13.539 1.00 43.40 O ATOM 1671 OE2 GLU A 103 -16.755 -8.679 15.006 1.00 32.42 O ATOM 0 H GLU A 103 -16.891 -9.975 10.869 1.00 44.14 H new ATOM 0 HA GLU A 103 -17.976 -7.636 11.959 1.00 4.10 H new ATOM 0 HB2 GLU A 103 -15.076 -8.095 11.179 1.00 3.40 H new ATOM 0 HB3 GLU A 103 -15.683 -7.070 12.464 1.00 3.40 H new ATOM 0 HG2 GLU A 103 -15.683 -10.098 12.358 1.00 25.10 H new ATOM 0 HG3 GLU A 103 -14.801 -9.065 13.465 1.00 25.10 H new ATOM 1678 N GLU A 104 -16.756 -7.326 8.933 1.00 4.42 N ATOM 1679 CA GLU A 104 -16.668 -6.431 7.785 1.00 71.43 C ATOM 1680 C GLU A 104 -18.019 -5.785 7.495 1.00 55.44 C ATOM 1681 O GLU A 104 -18.087 -4.674 6.970 1.00 43.40 O ATOM 1682 CB GLU A 104 -16.181 -7.195 6.552 1.00 62.24 C ATOM 1683 CG GLU A 104 -16.178 -6.362 5.281 1.00 10.32 C ATOM 1684 CD GLU A 104 -15.305 -6.958 4.194 1.00 33.20 C ATOM 1685 OE1 GLU A 104 -14.391 -7.740 4.530 1.00 1.33 O ATOM 1686 OE2 GLU A 104 -15.536 -6.644 3.008 1.00 51.31 O ATOM 0 H GLU A 104 -16.472 -8.287 8.742 1.00 4.42 H new ATOM 0 HA GLU A 104 -15.952 -5.644 8.023 1.00 71.43 H new ATOM 0 HB2 GLU A 104 -15.172 -7.562 6.738 1.00 62.24 H new ATOM 0 HB3 GLU A 104 -16.816 -8.069 6.402 1.00 62.24 H new ATOM 0 HG2 GLU A 104 -17.199 -6.268 4.911 1.00 10.32 H new ATOM 0 HG3 GLU A 104 -15.828 -5.356 5.512 1.00 10.32 H new TER 1693 GLU A 104